CAS 545-06-2 MFCD00001842-Trichloroacetonitrile 三氯乙腈 TAO{mole}

Trichloroacetonitrile 三氯乙腈

CAS 545-06-2 MFCD00001842

化学结构图

SMILES: N#CC(Cl)(Cl)Cl

化学属性

Mol. Formula	C2Cl3N
Mol. Weight	144
Refractive index	1.4380 to 1.4420
Boiling Point	83-84
Density	1.44
Melting Point	-42
TSCA	Yes
Vapor Pressure	58 mmHg ( 20 °C)
Solubility	不溶于水。
Flash Point	195°C(lit.)
Stability	催泪; 对空气敏感
pH	:A

别名和识别编码

Chemical Name	Trichloroacetonitrile
CAS Number	545-06-2
PubChem Substance ID	11011
EC Number	208-885-7
Beilstein Registry Number	605572
MDL Number	MFCD00001842
Reaxys-RN	605572
Merck Number	9628
Synonym	2,2,2-Trichloroacetonitrile CCl3CN Chlorocyanohydrin Cyanotrichlormethan Cyanotrichloromethane Cyanotrichloromethane; Trichloromethyl cyanide Nitrile trichloracetique TRIBROMOACETONITRILE TRICHLOROACETONITRILE TRICHLOROACETONITRILE, 1000MG, NEAT Trichlor-acetonitril Trichloracetonitril Trichloressigsäurenitril Trichlormethylkyanid Trichloro acetonitrile Trichloroacetonitrile Trichloroacetonitrile,97% Trichlorocyanomethane Trichloroethanenitrile Trichloromethyl cyanide Trichloromethylnitrile Trichlouracetonitril Trichlroacetonitrile Tritox acetonitrile, trichloro- acetonitrile,trichloro- {uni_ham
Alfabeta Name	TRICHLOROACETONITRILE
Chemical Name Translation	三氯乙腈
Wiswesser Line Notation	NCXGGG
LabNetwork Molecule ID	LN00008065
InChI	InChI=1S/C2Cl3N/c3-2(4,5)1-6

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产品应用

用作杀虫剂。

安全信息

GHS Symbol

WGK Germany3

Hazard statements

H301 Toxic if swallowed 吞食有毒
H301+H311+H331
H301+H331
H311 Toxic in contact with skin 皮肤接触中毒
H318 Causes serious eye damage 严重伤害眼睛
H331 Toxic if inhaled 吸入中毒
H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。

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

Hazard Codes 6.1 T,N

RTECSAM2450000

Precautionary statements

P101 If medical advice is needed,have product container or label at hand. 如果你想要医药方面的建议，记得随手带上药瓶和标签
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。
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。
P281 Use personal protective equipment as required. 使用所需的个人防护装备。
P301+P310
P301+P310+P330
P301+P312
P302+P350
P302+P352
P302+P352+P312+P362+P364
P304+P340
P304+P340+P311
P305+P351+P338
P305+P351+P338+P337+P313
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。
P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
P314 Get medical advice/attention if you feel unwell. 获取医疗咨询/就医，如果你觉得不舒服
P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
P330 Rinse mouth. 漱口
P332+P313
P337+P313
P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
P403+P233
P405 Store locked up. 上锁保管。
P501 Dispose of contents/container to..… 处理内容物/容器.....

Signal word Danger

Safety Statements

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）；
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；

Risk Statements

R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入，皮肤接触及吞食都有毒
R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
R51/53

UN Number 3276 UN 3276 6.1/PG 3 UN3276

Packing GroupIII

Warnings 危化品目录(2015) IRRITANT

Hazard Class6.1

Storage condition 0-6°C

TYPE OF TEST            : LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 311 ppm/5H
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - lacrimation
   Behavioral - somnolence (general depressed activity)
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   JIHTAB Journal of Industrial Hygiene and Toxicology.  (Cambridge, MA)
   V.18-31, 1936-49.  For publisher information, see AEHLAU.
   Volume(issue)/page/year: 31,235,1949

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 900 uL/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AIHAAP American Industrial Hygiene Association Journal.  (AIHA, 475 Wolf
   Ledges Pkwy., Akron, OH 44311)  V.19-    1958-  Volume(issue)/page/year:
   23,95,1962

TYPE OF TEST            : LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 311 ppm/5H
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - lacrimation
   Behavioral - somnolence (general depressed activity)
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   JIHTAB Journal of Industrial Hygiene and Toxicology.  (Cambridge, MA)
   V.18-31, 1936-49.  For publisher information, see AEHLAU.
   Volume(issue)/page/year: 31

TYPE OF TEST            : LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 250 ppm/4H
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AIHAAP American Industrial Hygiene Association Journal.  (AIHA, 475 Wolf
   Ledge

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 3333 ug/plate
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 8(Suppl
   7),1,1986

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 1 umol/L
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: PB84-246230

TYPE OF TEST            : Micronucleus test
ROUTE OF EXPOSURE       : Multiple routes
TEST SYSTEM             : Non-mammalian species
DOSE/DURATION           : 100 ug/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 341,289,1995

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Rodent - hamster Ovary
DOSE/DURATION           : 15 umol/L
REFERENCE :
   FAATDF Fundamental and Applied Toxicology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1981-  Volume(issue)/page/year:
   5,1065,1985

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 825 mg/kg
SEX/DURATION            : female 7-21 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Newborn - weaning or lactation index (e.g., #
   alive at weaning per # alive at day 4)
   Reproductive - Effects on Newborn - growth statistics (e.g.%, reduced weight
   gain)
REFERENCE :
   TXCYAC Toxicology.  (Elsevier Scientific Pub. Ireland, Ltd., POB 85,
   Limerick, Ireland) V.1-    1973-  Volume(issue)/page/year: 46,83,1987

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 455 mg/kg
SEX/DURATION            : female 6-18 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
REFERENCE :
   TJADAB Teratology, The International Journal of Abnormal Development. (Alan
   R. Liss, Inc., 41 E. 11th St., New York, NY 10003)  V.1-    1968-
   Volume(issue)/page/year: 38,113,1988

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 97500 ug/kg
SEX/DURATION            : female 6-18 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
   Reproductive - Effects on Embryo or Fetus - fetal death
REFERENCE :
   TJADAB Teratology, The International Journal of Abnormal Development. (Alan
   R. Liss, Inc., 41 E. 11th St., New York, NY 10003)  V.1-    1968-
   Volume(issue)/page/year: 38,113,1988

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Roden

Restrict 危险品

其他信息

MOL 文件:545-06-2.mol
检测方法:GC
图谱信息:三氯乙腈(545-06-2)红外图谱(IR1) 三氯乙腈(545-06-2)核磁图( 13 CNMR) 三氯乙腈(545-06-2)质谱(MS)
Hazard Note:Toxic/Lachrymatory
上游原料:五氧化二磷 --> 2,2,2-三氯乙酰胺
不溶于水。
灭火剂:1211、干石粉、二氧化碳、干砂。
海关编码:29269095
Sigma Aldrich:545-06-2(sigmaaldrich)
可燃性危险特性:受热分解产生有毒氰化物气体;与水、酸类发生反应
用途二:用作杀虫剂。
类别:农药
MSDS 信息:三氯乙腈(545-06-2).msds
TCI Shanghai:三氯乙腈 Trichloroacetonitrile,>;98.0%(GC)(545-06-2)
急性毒性:口服-大鼠 LD50: 250 毫克/公斤;静脉-小鼠 LD50:56 毫克/公斤
储运特性:库房通风低温干燥; 与酸类、氧化剂、食品添加剂分开存放
毒性分级:高毒
刺激数据:皮肤-兔子 5毫克/24小时重度；眼睛-兔子0.05 毫克/24小时重度
三氯乙腈价格(试剂级):更新日期产品编号产品名称包装价格 2014/06/02 T0372 三氯乙腈 Trichloroacetonitrile 500G 750元 2014/06/02 T0372 三氯乙腈 Trichloroacetonitrile 25G 85元 2010/06/21 139371000 三氯乙腈 Trichloroacetonitrile 98% 100 GR 1042元
下游产品:三氟乙酸
外观性质:无色液体。
Alfa Aesar:三氯乙腈,98% Trichloroacetonitrile, 98%(545-06-2)
Acros Organics:三氯乙腈 Trichloroacetonitrile, 98%(545-06-2)
用途一:用作增效剂、杀虫剂
蒸气压:58 mm Hg ( 20 °C)
敏感性:Lachrymatory