Dimethylcarbamoyl chloride 二甲胺基甲酰氯

CAS 79-44-7 MFCD00000635

化学结构图

79-44-7
SMILES: CN(C)C(=O)Cl

化学属性

Mol. FormulaC3 H6 Cl N O
Mol. Weight107.54
Refractive index1.4520 to 1.4540
Boiling Point
Density1.171
Melting PointNo Data Available
Flash Point68.33°C
TSCAYes
Solubility分解
Stability对湿度敏感
pH:A

别名和识别编码

Chemical NameDimethylcarbamoyl chloride
Synonym Carbamoyl chloride, dimethyl- Carbamyl chloride, N,N-dimethyl- DIMETHYLAMINOFORMYL CHLORIDE DIMETHYLCARBAMOYL CHLORIDE DMCC Dimethyl carbamoyl chloride Dimethylcarbamic acid chloride Dimethylcarbamoyl Chloride {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
MDL NumberMFCD00000635
CAS Number79-44-7
PubChem Substance ID87567335
EC Number201-208-6
Beilstein Registry Number878197
Chemical Name Translation二甲胺基甲酰氯
Reaxys-RN878197
Wiswesser Line NotationGVN1&1
LabNetwork Molecule IDLN00222428
InChIInChI=1S/C3H6ClNO/c1-5(2)3(4)6/h1-2H3
Canonical SMILESO=C(Cl)N(C)C
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分类

  • {Chemicalbook} 农药中间体: 杀虫剂中间体: 氨基甲酸酯类杀虫剂
  • {uni_hamburg} no charge; carbonyl chloride; 1fragment
  • {SNA} Acid Halides, Building Blocks, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks

产品应用

  • 用作医药、农药、染料、塑料、合成材料及其他精细有机化工产品的合成,例如用于生产溴化新期的明、甲基硫酸新斯的明、吡啶斯的明,氨基甲酸酯类杀虫剂等。

相关文献及参考

  • Short: II/25C
  • Short: III/20a
  • Beilstein:4,73

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H227 Combustible liquid 可燃液体
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H331 Toxic if inhaled 吸入中毒
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H350 May cause cancer 可能致癌
Personal Protective Equipment Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
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+P312+P330
  • P302+P352+P332+P313+P362+P364
  • P304+P340+P310
  • P305+P351+P338
  • P305+P351+P338+P310
  • P305+P351+P338+P337+P313
  • P308+P313
  • P311 Call a POISON CENTER or doctor/physician. 呼叫解毒中心或医生/医师。
  • P370+P378
  • 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
RTECSFD4200000
Packing GroupII
UN Number 2262 UN 2262 8/PG 2 UN2262
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R23 Toxic by inhalation 吸入有毒
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R45 May cause cancer 可能致癌
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);
  • 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 +4°C 2-8°C 4 4℃ {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Hazard Codes 8 T
Hazard Class8
Warnings 危化品目录(2015)
TYPE OF TEST            : TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 8 gm/kg/40W-I
TOXIC EFFECTS :
   Tumorigenic - neoplastic by RTECS criteria
   Tumorigenic - tumors at site of application
REFERENCE :
   JNCIAM Journal of the National Cancer Institute.  (Washington, DC)  V.1-60,
   1940-78.  For publisher information, see JJIND8.  Volume(issue)/page/year:

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 894 mg/kg/52W-I
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Skin and Appendages - tumors
   Tumorigenic - tumors at site of application
REFERENCE :
   JACTDZ Journal o

TYPE OF TEST            : TC - Toxic concentration (other than lowest)
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - hamster
DOSE/DURATION           : 1 ppm/6H/2Y-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Sense Organs and Special Senses (Olfaction) - tumors
REFERENCE :
   JEPTDQ Journal of Environmental Pathology and Toxicology.  (Park Forest
   South, IL)  V.1-5(3), 1977-81(?).  For publisher information, see JEPOEC.
   Volume(issue)/page/year: 4(1),107,1980

TYPE OF TEST            : TD

TYPE OF TEST            : TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 5200 mg/kg/26W-I
TOXIC EFFECTS :
   Tumorigenic - neoplastic by RTECS criteria
   Lungs, Thorax, or Respiration - tumors
   Tumorigenic - tumors at site of application
REFERENCE :
   JNCIAM Journal of the National Cancer Institute.  (Washington, DC)  V.1-60,
   1940-78.  For publisher information, see JJIND8.  Volume(issue)/page/year:
   48,15

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz.  (Darmstadt, Fed.
   Rep. Ger.)  V.1-25, 1951-75.  Volume(issue)/page/year: 24,71,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   ZAARAM Zentralblatt fuer Arbeitsmedizin und Arbeitsschutz.  (Darmstadt, Fed.
   Rep. Ger.)  V.1-25, 1951-75.  Volume(issue)/page/year: 24,71,1974

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 180 ppm/6H
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JEPTDQ Journal of Environmental Pathology and Toxicology.  (Park Forest
   South, IL)  V.1-5(3), 1977-81(?).  For publisher information, see JEPOEC.
   Volume(issue)/page/year: 4(1),107,1980

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,OCT1942

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 10 mg/L
REFERENCE :
   JJIND8 JNCI, Journal of the National Cancer Institute.  (Washington, DC)
   V.61-79, 1978-87. For publisher information, see JNCIEQ.

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 100 ug/plate
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 6(Suppl
   2),1,1984

TYPE OF TEST            : Morphological transformation
TEST SYSTEM             : Rodent - hamster Kidney
DOSE/DURATION           : 80 ug/L
REFERENCE :
   BJCAAI British Journal of Cancer.  (Macmillan Press Ltd., Houndmills,
   Basingstoke, Hants. RG21 2XS, UK)  V.1-    1947-  Volume(issue)/page/year:
   37,873,1978

TYPE OF TEST            : Mutation test systems - not otherwise specified
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 540 pmol/tube
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 33 ug/plate
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 5(Suppl
   1),3,1983

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Rodent - mouse Lymphocyte
DOSE/DURATION           : 187 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 97,49,1982

TYPE OF TEST            : Si

Restrict 危险品

其他信息

  • 方法一:二甲氨基甲酰氯是由二甲胺与光气反应制得。反应方程式:(CH 3 ) 2 NH+COCl 2 →(CH 3 ) 2 NCOCl 将甲苯加入反应锅内,在冷却的条件下通入光气吸收至计算量。在另一锅中由二甲胺水溶液发生气体二甲胺,经干燥后通入光气甲苯溶液中反应。反应结束后过滤除去盐酸盐,减压蒸馏,收集75℃(3.33kPa)馏分即为二甲氨基甲酰氯,收率55%。 二甲氨基甲酰氯还可由N,N-二甲基甲酰胺与三氯化磷反应后,再与氯化亚砜反应制得。反应方程式如下:HCON(CH 3 ) 2 +PCl 3 →[(CH 3 ) 2 N+=CHOPCl 2 ]Cl - [SOCl 2 ]→(CH 3 )2NCOCl 另外,亦可以Pd、PdCl 2 或RhCl 3 为催化剂,由二甲基氯化铵与一氧化碳反应制得。反应方程式:(CH 3 ) 2 NCl+CO[催化剂]→(CH 3 ) 2 NCOCl
  • 用途二:二甲氨基甲酰氯是氨基甲酸酯类杀虫剂如抗蚜威、唑蚜威等的中间体,也用作医药、染料、合成材料及其他精细化学品的中间体,如用于生产溴化新斯的明、甲基硫酸新斯的明、吡啶斯的明等。
  • MOL 文件:79-44-7.mol
  • 用途一:用作医药、农药中间体
  • 图谱信息:二甲氨基甲酰氯(79-44-7)质谱(MS) 二甲氨基甲酰氯(79-44-7)Raman光谱 二甲氨基甲酰氯(79-44-7)核磁图( 13 CNMR) 二甲氨基甲酰氯(79-44-7)红外图谱(IR1)
  • 敏感性:Moisture Sensitive
  • MSDS 信息:二甲基氨基甲酰氯(79-44-7).msds
  • 下游产品:N-4-异丙基苯基-N',N'-二甲基脲 --> 2-氰基吡啶-4-醛 --> 4-甲基-2-羧酸吡啶 --> 2-氰基吡啶-4-羧酸乙酯 --> 4-羟甲基吡啶-2-腈 --> 1,4,5,8-萘四甲酸 --> 偶氮二甲酰胺 --> 灭蚜松粉剂、可湿性粉剂、拌种剂 --> 1-(2-吡啶-2-基乙基)哌嗪 --> 3-(N,N-二甲氨基甲酰氧基)吡啶 --> 哌嗪-1-羧酸二甲胺 --> 溴化新斯的明
  • F:9
  • 上游原料:氯 --> 二甲胺 --> 一氧化碳 --> 冶金焦 --> 二甲胺水溶液 --> 氯胺 T
  • 外观性质:无色透明液体。
  • 用途三:用作医药、农药、染料、塑料、合成材料及其他精细有机化工产品的合成,例如用于生产溴化新期的明、甲基硫酸新斯的明、吡啶斯的明,氨基甲酸酯类杀虫剂等。
  • 方法二:以二甲胺为原料,与光气进行甲酰氯化反应,得二甲基甲酰氯胺粗品,经脱酸而得成品。
  • Sigma Aldrich:79-44-7(sigmaaldrich)
  • 二甲氨基甲酰氯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D0695 二甲基氨基甲酰氯 Dimethylcarbamoyl Chloride 500G 982元 2014/06/02 D0695 二甲基氨基甲酰氯 Dimethylcarbamoyl Chloride 25G 206元 2010/05/25 L03415 二甲氨基甲酰氯, 96% Dimethylcarbamyl chloride, 96% 25g 238元
  • TCI Shanghai:N,N-二甲基氨基甲酰氯 Dimethylcarbamoyl Chloride,>;97.0%(GC)(79-44-7)
  • Alfa Aesar:二甲氨基甲酰氯,96% Dimethylcarbamyl chloride, 96%(79-44-7)
  • 溶于乙醚、二硫化碳和苯等有机溶剂。遇水分解。

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