CAS 108-43-0 MFCD00002256-3-Chlorophenol 间氯苯酚 TAO{mole}

3-Chlorophenol 间氯苯酚

CAS 108-43-0 MFCD00002256

化学结构图

SMILES: Oc1cccc(Cl)c1

化学属性

Mol. Formula	C6H5ClO
Mol. Weight	128.56
Refractive index	n20/D 1.563(lit.)
Boiling Point	-
Density	1.218 g/mL at 25 °C(lit.)
Melting Point	31-34 °C(lit.)
Flash Point	>110°C
TSCA	Yes
Solubility	微溶于水，溶于醇、醚、碱液。
Stability	对光敏感

别名和识别编码

Chemical Name	3-Chlorophenol
CAS Number	108-43-0
Synonym	3-Chlorophenol {LY} 3-Chlorophenol Chlorophenol (meta-) M-CHLOROPHENOL MONOCHLOROPH {} {LY} 3-Chlorophenol {} {} {LY} 3-Chlorophenol {} {} {} {LY} 3-Chlorophenol {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {}
PubChem Substance ID	87565403
EC Number	203-582-6
Beilstein Registry Number	6,185
MDL Number	-
Reaxys-RN	1634401
Merck Number	2154
Chemical Name Translation	间氯苯酚
Wiswesser Line Notation	QR CG
LabNetwork Molecule ID	LN00194307
InChI	InChI=1S/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H
Canonical SMILES	OC1=CC=CC(Cl)=C1

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产品应用

本品可用于有机合成，间氯苯酚还用于显微分析。

安全信息

GHS Symbol

WGK Germany2

Hazard statements

H315 Causes skin irritation 会刺激皮肤
H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
H318 Causes serious eye damage 严重伤害眼睛
H302+H312+H332
H332 Harmful if inhaled 吸入有害
H302 Harmful if swallowed 吞食有害
H312 Harmful in contact with skin 皮肤接触有害

Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves

Hazard Codes Xn;N Xn,N

RTECSSK2450000

Precautionary statements

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。
P305+P351+P338
P332+P313
P501 Dispose of contents/container to..… 处理内容物/容器.....
P301+P312+P330
P302+P350
P337+P313
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。
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。
P305+P351+P338+P310
P302+P352+P312+P362+P364
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。
P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
P304+P340+P312
P273 Avoid release to the environment. 避免释放到环境中。
P305+P351+P338+P337+P313
P308+P311
P405 Store locked up. 上锁保管。
P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
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。
P201 Obtain special instructions before use. 使用前获取专门指示。

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

Safety Statements

S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
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；
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；
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；

Risk Statements

R51/53
R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

UN Number 2020 UN 2020 6.1/PG 3 UN2020

Packing GroupIII

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

Hazard Class6.1

Warnings 危化品目录(2015)

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 6000 mg/kg/15W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Skin and Appendages - tumors
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   19,413,1959

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 521 mg/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
   TOLED5 Toxicology Letters.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1977-  Volume(issue)/page/year: 29,39,1985

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 355 mg/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - convulsions or effect on seizure threshold
   Nutritional and Gross Metabolic - body temperature increase
REFERENCE :
   BJPCAL British Journal of Pharmacology and Chemotherapy.  (London, UK)
   V.1-33, 1946-68.  For publisher information, see BJPCBM.
   Volume(issue)/page/year: 13,20,1958

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 570 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FEPRA7 Federation Proceedings, Federation of American Societies for
   Experimental Biology. (Bethesda, MD)  V.1-46, 1942-87.
   Volume(issue)/page/year: 2,76,1943

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1390 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FEPRA7 Federation Proceedings, Federation of American Societies for
   Experimental Biology. (Bethesda, MD)  V.1-46, 1942-87.
   Volume(issue)/page/year: 2,76,1943

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 10 ug/plate
REFERENCE :
   TECSDY Toxicological and Environmental Chemistry.  (Gordon & Breach Science
   Pub. Inc., 1 Park Ave., New York, NY 10016)  V.3(3/4)-    1981-
   Volume(issue)/page/year: 14,143,1987

Restrict 危险品

其他信息

在空气中变色。溶于乙醇、乙醚和苛性碱溶液，微溶于冷水。低毒，半数致死量(大鼠，经口)570mg/kg。有腐蚀性。
TCI Shanghai:3-氯苯酚 3-Chlorophenol,>;98.0%(GC)(108-43-0)
Alfa Aesar:3-氯苯酚,98+% 3-Chlorophenol, 98+%(108-43-0)
{
检测方法:GC
{Chemical
图谱信息:3-氯苯酚(108-43-0)核磁图( 1 HNMR) 3-氯苯酚(108-43-0)核磁图( 13 CNMR) 3-氯苯酚(108-43-0)质谱(MS) 3-氯苯酚(108-43-0)
所属类别二:农药中间体: 杀菌剂中间体: 三唑类杀菌剂
用途四:间氯苯酚是植物生长调节剂调果酸的中间体。
MOL 文件:108-43-0.mol
3-氯苯酚价格(试剂级):更新日期产品编号产品名
可燃性危险特性:
用途五:该品可用于有机合成，其异构体邻氯苯酚和对氯苯酚在农药、染料、医药工业上占有重要地位，用它替代邻氯苯酚或对氯苯酚可以开发出性能优异的农药、医
用途一:用于制药、染料工业及有机合成，也用作消毒剂
毒性分级:中毒
Acros Organics:3-氯苯酚 3-Chlorophenol, 99%(108-43-0)
类别:有毒物品
用途六:本品可用于有机合成，间氯苯酚还用于显微分析。
所属类别一:农药中间体: 植物生长调节剂中间体
下游产品:4-氯-2-羟基苯甲醛 --> 6-氯水杨醛 --> 3-氯苯氧基乙酰基氯
用途三:对氯苯酚又称4-氯苯酚，是重要的医药、农药和染料中间体，在农药上可用以合成三唑酮、三唑醇、萘乙酸(对氯苯氧乙酸)、丙虫磷、毒鼠磷、杀螟腈、苯腈磷、杀螨脒、螨卵酯、除螨酯、咪菌酮等品种。
方法一:其制备方法是由苯酚直接氯化，氯化剂为次氯酸钠，得到间氯苯酚、对氯苯酚和邻氯苯酚，进行分离而得到间氯苯酚。也可以用间氯苯胺重氮化，可以得到纯度较高的间氯苯酚。
方法二:其制备方法有以下三种。二氯硫酰作为氯化剂使苯酚氯化将苯酚加热熔融后，温度降到40℃，慢慢加入二氯硫酰，约需40～50h，边搅拌边滴加二氯硫酰，待二氯硫酰加完后，再升温至30～40℃保温数小时，冷至室温，用水洗涤，再用碳酸钠洗涤和水洗涤得到的邻位和对位产品，然后减压蒸馏，分离，冷却结晶得到产品。对氯苯胺重氮化将对氯苯胺加入到反应器中，加入水、亚硝酸钠和硫酸，在0℃左右进行重氮化得到重氮盐，然后将重氮盐进行水解即得产品。用氯气直接氯化将苯酚加热熔融后加入铁粉等催化剂，控制一定的温度通入氯气，通入的氯气量要控制，通氯气结束后再保温数小时，冷却进行洗涤等后处理，然后再在减压下进行蒸馏，分离邻氯苯酚和对氯苯酚，冷却得到产品。综上所述，3种方法中对氯苯胺重氮化法由于工艺复杂，成本较高，且废水较多，工业上已很少使用；二氯硫酰法在铁催化剂存在下进行氯化反应时间长，生产能力低，用二氯硫酰成本较高，但该方法对位异构体产率较高，达70％～75％，目前还有不少工厂采用此法；最近我国用氯气直接氯化法工艺流程简单，无须溶剂，投资少，同时成本较低，是一条经济合理的工艺路线，但该法生产对氯苯酚对设备腐蚀严重。
3-氯苯酚价格(试剂级):更新日期产品编号产品名称包装价格 2014/06/02 C0242 3-氯苯酚 3-Chlorophenol 25G 366元 2014/06/02 C0242 3-氯苯酚 3-Chlorophenol 500G 3400元 2010/06/21 109810050 3-氯苯酚 3-Chlorophenol 99% 5 GR 16
F:9
用途七:用作有机合成中间体。用于ICP-AES、AAS、AFS、ICP-MS、离子色谱等。滴定分析用标准溶液。
方法三:由间氯苯胺用通常方法重