CAS 821-48-7 MFCD00012515-Bis(2-chloroethyl)amine Hydrochloride 双(2-氯乙基)胺盐酸盐 TAO{mole}

Bis(2-chloroethyl)amine Hydrochloride 双(2-氯乙基)胺盐酸盐

CAS 821-48-7 MFCD00012515

化学结构图

SMILES: Cl.ClCCNCCCl

化学属性

Mol. Formula	C4H10Cl3N
Mol. Weight	178.49
Density	1.125
Melting Point	212-214°C
TSCA	Yes
Solubility	可溶

别名和识别编码

Chemical Name	Bis(2-chloroethyl)amine Hydrochloride
CAS Number	821-48-7
Alfabeta Name	BISCHLOROETHYLAMINEHYDROCHLORIDE 2()-
MDL Number	MFCD00012515
Synonym	Bis(2-chloroethyl)amine (hydrochloride) {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bis(2-chloroethyl)amine (hydrochloride) {} {} {} {} {} {}
EC Number	212-479-5
Beilstein Registry Number	3550356
PubChem Substance ID	522769
Reaxys-RN	3550356
Chemical Name Translation	双(2-氯乙基)胺盐酸盐
Wiswesser Line Notation	G2M2G &GH
LabNetwork Molecule ID	LN00173376
InChI	InChI=1S/C4H9Cl2N.ClH/c5-1-3-7-4-2-6;/h7H,1-4H2;1H
Canonical SMILES	ClCCNCCCl.Cl

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产品应用

医药中间体。

安全信息

Warnings IRRITANT

Signal word Warning

GHS Symbol

WGK Germany3

Safety Statements

S24 Avoid contact with skin 避免皮肤接触；
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；
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）；

Risk Statements

R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性

Precautionary statements

P201 Obtain special instructions before use. 使用前获取专门指示。
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。
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。
P301+P312+P330
P302+P352+P332+P313+P362+P364
P305+P351+P338
P305+P351+P338+P337+P313
P332+P313
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
P405 Store locked up. 上锁保管。
P501 Dispose of contents/container to..… 处理内容物/容器.....

Hazard statements

H315 Causes skin irritation 会刺激皮肤
H319 Causes serious eye irritation 严重刺激眼睛
H335 May cause respiratory irritation 可能导致呼吸道刺激
H302 Harmful if swallowed 吞食有害

RTECSIA1225000

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

Packing GroupII

UN Number 2811 UN2923

Hazard Codes Xi,T Xi

Hazard Class8

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 160 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ZKKOBW Zeitschrift fuer Krebsforschung und Klinische Onkologie.  (Berlin,
   Fed. Rep. Ger.)  V.76-92, 1971-78.  For publisher information, see JCROD7.
   Volume(issue)/page/year: 84,227,1975

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 280 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARPMAS Archiv der Pharmazie (Weinheim, Germany)  (VCH Pub., Inc., 303 NW
   12th Ave., Deerfield Beach, FL 33441)  V.51-261, 1835-1923; V.305-    1972-
   Volume(issue)/page/year: 306,64,1973

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 11,143,1961

TYPE OF TEST            : LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1000 mg/m3/10M
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NDRC** National Defense Research Committee, Office of Scientific Research
   and Development, Progress Report.  Volume(issue)/page/year:
   NDCrc-132,JUL1942

TYPE OF TEST            : LD50 - Lethal dose, 5

TYPE OF TEST            : Phage inhibition capacity
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 200 mg/L
REFERENCE :
   ARMKA7 Archiv fuer Mikrobiologie.  (Berlin, Fed. Rep. Ger.)  V.1-94,
   1930-73.  For publisher information, see AMICCW.  Volume(issue)/page/year:
   51,9,1965

TYPE OF TEST            : Sister chromatid exchange
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 250 ug/L
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 5,1637,1984

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Microorganism - not otherwise specified
DOSE/DURATION           : 20 gm/L
REFERENCE :
   STBIBN Studia Biophysica.  (Akademie-Verlag GmbH, Postfach 1233, Berlin
   DDR-1086, Ger. Dem. Rep.) V.1-    1966-  Volume(issue)/page/year:
   117,99,1987

TYPE OF TEST            : DNA adduct
TEST SYSTEM             : Rodent - mouse Ascites tumor
DOSE/DURATION           : 170 umol/kg
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   33,1048,1973

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 100 ug/plate
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 5,1637,1984

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Human Lymphocyte
DOSE/DURATION           : 1 mg/L
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/pa

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 2500 ug/kg
SEX/DURATION            : female 11 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: 4,141,1971

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 40 mg/kg
SEX/DURATION            : female 11 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Specific Developmental Abnormalities - Central Nervous System
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
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: 4,141,1971

Storage condition 2-8°C, sealed storage, away from moisture {LY} 2-8°C, sealed storage, away from moisture Store at room temperature {} {LY} 2-8°C, sealed storage, away from moisture {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed st

其他信息

用途一:用作医药中间体
下游产品:1-氨基-4-(2-羟乙基)哌嗪 --> 1-(3-三氟甲基苯基)哌嗪 --> 4-氰基-4-苯基哌嗪 --> 硫代吗啉 --> 1-(3,5-二氯苯基)哌嗪 --> 1-(3-氟苯基)哌嗪 --> 1-(1-苯基乙基)哌嗪 --> 1-(4-甲氧基苯基)哌嗪 --> 1-(3-氯苯基)哌嗪盐酸盐 --> 3-(4-甲基哌嗪-1-基)苯硼酸 --> 1-(3,4-二氯苯基)哌嗪 --> 1-(4-甲氧基苯基)哌嗪盐酸盐 --> 4-(4-甲基-1-哌嗪基)苯硼酸 --> 4-吗琳基-2-乙基哌嗪 --> 1-(2-甲氧基苯基)哌嗪氢溴酸盐 --> 1-(3-（甲基苯基）哌啶 --> 1-(3-甲氧基苯基)哌嗪 --> 1-(2-氟苯基)哌嗪盐酸盐 --> N,N-双(2-氯乙基)氨基甲酸叔丁酯 --> 1-(4-氯苯基)哌嗪 --> 1-(2-甲基苯基)哌嗪 --> 1-(4-甲基苯基)哌嗪 --> 1-(2-甲基苯基)哌嗪盐酸盐
Sigma Aldrich:821-48-7(sigmaaldrich)
海关编码:29211980
灭火剂:干粉,泡沫,沙土,二氧化碳, 雾状水
类别:有毒物品
急性毒性:腹腔-大鼠 LD50: 100 毫克/公斤; 皮下-小鼠 LD50: 20 毫克/公斤
Hazard Note:Irritant/Toxic
MSDS 信息:双(2-氯乙基)胺盐酸盐(821-48-7).msds
敏感性:Hygroscopic
图谱信息:二(2-氯乙基)胺盐酸盐(821-48-7)核磁图( 1 HNMR) 二(2-氯乙基)胺盐酸盐(821-48-7)核磁图( 13 CNMR) 二(2-氯乙基)胺盐酸盐(821-48-7)质谱(MS) 二(2-氯乙基)胺盐酸盐(821-48-7)红外图谱(IR1) 二(2-氯乙基)胺盐酸盐(821-48-7)红外图谱(IR2)
TCI Shanghai:双(2-氯乙基)胺盐酸盐 Bis(2-chloroethyl)amine Hydrochloride,>;99.0%(T)(821-48-7)
可燃性危险特性:可燃; 燃烧产生有毒氮氧化物, 氯化物和氯化氢烟雾
方法一:由二乙醇胺和氯化亚砜反应得到。将氯化亚砜溶于氯仿中，于0℃以下滴加二乙醇胺和氯仿的混合液。控制滴加速度，使温度维持在-4-6℃，加完后，保温搅拌30min。再在室温搅拌1h，加热至60-65℃，待结晶全部析出后，加无水乙醇，加热回流使全部溶解。趁热倒出，自然冷却，析出结晶。次日过滤，用氯仿或无水乙醇洗涤2次。干燥，得成品，收率76%。
外观性质:灰白色粉末。
毒性分级:高毒
二(2-氯乙基)胺盐酸盐价格(试剂级):更新日期产品编号产品名称包装价格 2011/08/23 LA1180101 N,N-二异丙基乙胺;N-乙基二异丙胺; 1,1′-二甲基三乙胺 100ml 344元 2011/04/16 B1210 双(2-氯乙基)胺盐酸盐 Bis(2-chloroethyl)amine Hydrochloride 500G 2210元 2011/04/16 B1210 双(2-氯乙基)胺盐酸盐 Bis(2-chloroethyl)amine Hydrochloride 25G 291元
上游原料:二乙醇胺
Acros Organics:双（2-氯乙基）胺盐酸盐 Bis(2-chloroethyl)amine hydrochloride, 98%(821-48-7)
储运特性:库房通风低温干燥; 与食品原料分开存放
MOL 文件:821-48-7.mol
Alfa Aesar:双(2-氯乙基)胺盐酸盐,98% Bis(2-chloroethyl)amine hydrochloride, 98%(821-48-7)