CAS 100-44-7 MFCD00000889-Benzyl Chloride 苄基氯 TAO{mole}

Benzyl Chloride 苄基氯

CAS 100-44-7 MFCD00000889

化学结构图

SMILES: ClCc1ccccc1

化学属性

Mol. Formula	C7H7Cl
Mol. Weight	127
Refractive index	1.5370 to 1.5400
Boiling Point	177-181
Density	1.1
Melting Point	-43
Flash Point	67°C(lit.)
TSCA	Yes
Solubility	不溶于水，可混溶于乙醇、氯仿等多数有机溶剂。
Autoignition Point	1085 °F
Vapor Density	4.36 (vs air)
Vapor Pressure	10.3 mmHg ( 60 °C)
Stability	对湿度、光线敏感
pH	-:A
Danger-Level	-
Redox	-

别名和识别编码

Chemical Name	Benzyl Chloride
CAS Number	100-44-7
Synonym	(Chloromethyl)benzene (chloromethyl)-Benzene (chloromethyl)-benzen (chloromethyl)benzene 1-Chlormethylbenzol 6-(Chloromethyl)benzene ?-Chlorotoluene A-CHLOROTOLUENE A-Chlortoluol AKO ALPHA-CHLOROTOLUENE Alpha-chlorotoluene BENZYL CHLORIDE Benzene, (chloromethyl)- Benzile Benzile(cloruro di) Benzyl Chloride Benzyl chloride Benzylchlorid Benzyle (chlorure de) C₇H₇Cl (chloromethyl-benzene) Chloromethylbenzene Chlorophenylmethane NCI-C06360 Phenylmethyl Chloride Phenylmethyl chloride RCRA waste number P028 Toluene, a-chloro- Toluene, α-chloro- Tolyl Chloride {}
PubChem Substance ID	87563455
Beilstein Registry Number	471308
MDL Number	MFCD00000889
Reaxys-RN	471308
Merck Number	1129
EC Number	202-853-6
Chemical Name Translation	苄基氯
Wiswesser Line Notation	G1R
LabNetwork Molecule ID	LN00196061
InChI	InChI=1S/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H2

信息真实价格透明资金保障专业采购外包团队在线服务

品牌质保精细包装现货库存一流品牌服务

产品应用

制造香料、染料和人造树脂。有机合成。

安全信息

GHS Symbol

WGK Germany3

Hazard Codes 6.1 T T+

Hazard statements

H315 Causes skin irritation 会刺激皮肤
H331 Toxic if inhaled 吸入中毒
H302 Harmful if swallowed 吞食有害
H335 May cause respiratory irritation 可能导致呼吸道刺激
H350 May cause cancer 可能致癌
H318 Causes serious eye damage 严重伤害眼睛
H373 May causes damage to organs through prolonged or repeated exposure 长期或频繁接触可能会损伤器官
H340 May cause genetic defects 可能导致遗传性缺陷
H317 May cause an allergic skin reaction 可能导致皮肤过敏
H330 Fatal if inhaled 吸入致命
H226 Flammable liquid and vapour 易燃液体和蒸气
H227 Combustible liquid 可燃液体

Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

RTECSXS8925000

Precautionary statements

P201 Obtain special instructions before use. 使用前获取专门指示。
P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前，切勿操作。
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
P273 Avoid release to the environment. 避免释放到环境中。
P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
P284 Wear respiratory protection.? 佩戴呼吸保护装置。
P301+P330+P331
P301+P330+P331+P310
P303+P361+P353
P304+P340+P310
P304+P340+P312
P305+P351+P338
P305+P351+P338+P310
P308+P313
P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
P311 Call a POISON CENTER or doctor/physician. 呼叫解毒中心或医生/医师。
P403+P233
P501 Dispose of contents/container to..… 处理内容物/容器.....

Signal word Danger Warning {} {} {} {} {} {} {} {} {} {} {TCI}

UN Number 1738 UN 1738 6.1/PG 2 UN1738

Risk Statements

R22 Harmful if swallowed 吞咽有害
R23 Toxic by inhalation 吸入有毒
R26 Very toxic by inhalation 吸入极毒
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
R45 May cause cancer 可能致癌
R46 May cause inheritable genetic damage 可能引起遗传基因损害
R48/22

Safety Statements

S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后，立即用大量…（由生产厂家指定）冲洗；
S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
S39 Wear eye/face protection 戴眼睛/面孔保护装置；
S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
S53 Avoid exposure - obtain special instructions before use 避免接触，使用前获得特别指示说明；

Storage condition Moisture Sensitive 密封阴凉干燥保存。 0-6°C 充氩保存

Packing GroupII

Hazard Class6.1/8

Warnings 危化品目录(2015)

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 31 gm/kg/2Y-I
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Vascular - tumors
   Gastrointestinal - tumors
REFERENCE :
   JJIND8 JNCI, Journal of the National Cancer Institute.  (Washington, DC)
   V.61-79, 1978-87. For publisher information, see JNCIEQ.
   Volume(issue)/page/year: 76,1231,1986

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 9200 mg/kg/50W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Lungs, Thorax, or Respiration - tumors
   Skin and Appendages - tumors
REFERENCE :
   GANNA2 Gann.  Japanese Journal of Cancer Research.  (Tokyo, Japan)  V.1-75,
   1907-84.  For publisher information, see JJCREP.  Volume(issue)/page/year:
   72,655,1981

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 50 mg/kg
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 6,576,1968

TYPE OF TEST            : TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2100 mg/kg/53W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   ZEKBAI Zeitschrift fuer Krebsforschung.  (Berlin, Fed. Rep. Ger.)  V.1-75,
   1903-71.  For publisher i

TYPE OF TEST            : LD50 - Let

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 1500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 40(1),92,1975

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1231 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: PB214-270

TYPE OF TEST            : LD50 - Le

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ZEKBAI Zeitschrift fuer Krebsforschung.  (Berlin, Fed. Rep. Ger.)  V.1-75,
   1903-71.  For publisher information, see JCROD7.  Volume(issue)/page/year:
   74,241,1970

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 625 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 44(3),11,1979

{h

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Human Fibroblast
DOSE/DURATION           : 1 mmol/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 145,209,1985

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 666 ug/plate
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 9(Suppl
   9),1,1987

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 6300 nmol/plate
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 58,143,1978

TYPE OF TEST            : Gene conversion and mitotic recombination
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 400 ppm
REFERENCE :
   JJIND8 JNCI, Journal of the National Cancer Institute.  (Washington, DC)
   V.61-79, 1978-87. For publisher information, see JNCIEQ.
   Volume(issue)/page/year: 62,901,1979

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 7900 nmol/plate
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    196

TYPE OF TEST

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Bacteria - Bacillus subtilis
DOSE/DURATION           : 79200 nmol/disc
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 58,143,1978

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 1 gm/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
REFERENCE :
   JTEHD6 Journal of Toxicology and Environmental Health.  (Hemisphere Pub.,
   1025 Vermont Ave., NW, Washington, DC 20005)  V.1-    1975/76-
   Volume(issue)/page/year: 17,51,1986

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 250 mg/kg
SEX/DURATION            : male 5 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - spermatogenesis (incl. genetic material,
   sperm morphology, motility, and count)
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 100,345,1982

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 2500 mg/kg
SEX/DURATION            : male 5 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - spermatogenesis (incl. genetic material,
   sperm morphology, motility, and count)
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 100,345,1982

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 11 ug/kg
SEX/DURATION            : female 1-19 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Embryo or Fetus - fetal death

Restrict -

其他信息

外观性质:无色液体，有不愉快的刺激性气味。
蒸气压:10.3 mm Hg ( 60 °C)
用途一:用于有机合成
Alfa Aesar:苄基氯,99%,stab. Benzyl chloride, 99%, stab.(100-44-7)
方法二:1.甲苯连续光氯化法将干燥不含铁质的甲苯加到无铁反应器中，在光照下进行高温氯化。然后分馏氯化产物，即得氯化苄，副产氯化氢用水吸收得盐酸，副产α-二氯甲基苯可经水解作用制成苯甲醛。2.甲苯无光热氯化法甲苯先静置6h以上以除去铁质，再经高位槽送入氯化锅中，以蒸气加热至沸腾后停止加热，通入氯气进行氯化，连续反应制得的氯化苄通过底部溢流管冷却后进入贮槽。3.甲苯在催化剂过氧化物存在下与氯化亚砜反应。4.在氯化锌催化下，苯环氯甲基化。
Sigma Aldrich:100-44-7(sigmaaldrich)
可燃性危险特性:明火可燃;与水、氧化剂
可燃。有不愉快的
{Chemical
下游产品:美克洛嗪 --> 柔软剂 DOD --> 6-苄氨基嘌呤 --> α-乙酰氨基对甲苯磺酰氯 --> 苄基三甲基氯化铵 --> N-乙基-N-苄基苯胺 --> N-苄基氯化辛可宁丁 --> O,O-二异丙基硫代磷酸铵 --> 柳酸苄酯 --> 溶解盐SV --> 肉桂酸苄酯 --> 丙酸苄酯 --> 苄醚 --> α-异丁基苯乙醇 --> 2,3-二苯基丙酸 --> 5-苄氧基吲哚-2-甲酸乙酯 --> 助拨剂 O,二甲基苄基苯基氯化铵 --> 大红色基LG --> 丁酸苯甲酯 --> 1-苄基-3-羟基-1H-吲唑 --> 氯化二乙基硬脂酰乙基苄基铵 --> S-苄基硫脲盐酸盐 --> 十四烷基二甲基苄基氯化铵 --> 3-苄氧基苯酚 --> 邻苯二甲酸丁苄酯 --> 农乳 BCH --> S-苄基-L-半胱氨酸 --> 4-苄基吡啶 --> 1-苄氧基-2-甲氧基-4-丙烯基苯 --> 邻苯二甲酸二苄酯 -->
用途四:有机合成中间体，广泛用于医药、农药、香料、染料助剂、合成树脂等方面。氯化苄的主要衍生产品如下：（1）苄基步丁胺：氯化苄叔丁胺反应而得。（2）邻苯二甲酸丁苄酯（BBP）：先由邻苯二甲酸酐与丁醇生成苯二甲酸单丁酯，再继续与氢氧化钠生成单丁酯钠盐，钠盐与氯化苄生成BBP。广泛用作PVC塑料制品的主增塑剂。（3）苄醇：氯化苄在碱存在下加热水解而得。是氯化苄的重要衍生物之一。是吨位较大的精细化工产品。芳醇制备的苯甲酸苄酯、乙酸苄酯、丙酸苄酯可用作香料、溶剂等。（4）苄基季胺盐：例如十二烷基二甲基苄基氯化铵（洁而灭）、十二烷基二甲基苄基溴化铵（新洁而灭）。苄基季胺盐阳离子表面活性剂主要用作消毒剂、疏水剂、腐蚀抑制剂、去乳化剂、相转移催化剂。（5）苯乙腈：氯化苄和氰化钠缩合而得，是氯化苄的重要衍生物之一，主要用于农药辛硫磷，乙基稻丰散，医药咳必清、地巴唑的生产。用苯乙腈制备的一系列中间体有很多重要用途。例如苯乙酸、苯乙醛、邻乙苯基苯甲酸、2-氯代苯乙酸乙酯、苯乙胺、α-苯乙酰胺、苯乙酸乙酯、β-苯乙醇。（6）二苯甲烷：氯化苄在铝汞齐催化剂存在下与苯反应而得，用于有机合成材料。二苯甲烷经硝酸氧化制得二苯甲酮，主要用作紫外线吸收剂、医药中间体。（7）对氯氯苄：氯化苄低温氯化而得，用于进一步制备对氯苯甲醇、对氯苯甲醛、对氯苯乙腈、对氯苯甲酸、对氯二苯甲烷、对氯氰苄，主要用于医药生产。（8）二苄基硫醚：氯化苄与硫化钠反应而得，用于有机合成。（9）N-甲基苄胺：氯化苄与-甲胺在苯溶剂中反应制得，用作医药中间体。（10）苄胺：氯化苄与乌洛托品反应、或与氨水反应而得，苄胺与甲醛、甲酸反应合成的N，N-二甲基苄胺，是新洁而灭的原料。（11）二苄胺：氯化苄与液氨在乙醇中反应而得，用于有机合成。（12）S-苄基异硫脲：氯化苄与硫脲缩合而得，用作试剂和有机合成的原料。（13）肉桂酸苄酯：由肉桂酸与氯化苄反应或肉桂酸甲酯与过量的苄醇反应而得，用作香料的定香剂和变调剂。（14）邻羟基苯甲酸苄酯：由氯化苄与邻羟基苯甲酸钠和二甲基亚砜制得，在生产香料中是重要的中间体。（15）苯甲醛：氯化苄酸解或碱解而得，是氯化苄重要的衍生物之一。用于生产肉桂酸、肉桂醛、α-戊基肉桂醛、α-乙基肉桂醛、苯丁烯酮等。
F:8-19
用途二:是制造染料、香料、药物、合成鞣剂、合成树脂等的原料