Methyl alpha-chloroacrylate

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Names

[ CAS No. ]:
80-63-7

[ Name ]:
Methyl alpha-chloroacrylate

[Synonym ]:
Methyl 2-chloro-2-propenoate
2-Propenoic acid,2-chloro-,methyl ester
Methyl-2-chloroacrylate
methyl 2-chloropropenoate
EINECS 201-298-7
2-Chloroacrylic acid,methyl ester
Acrylic acid,2-chloro-,methyl ester
Methyl alpha-chloroacrylate
Methyl 2-chloro-2-propenate
Acrylic acid, 2-chloro-, methyl ester

Chemical & Physical Properties

[ Density]:
1.155g/cm3

[ Boiling Point ]:
124.6ºC at 760 mmHg

[ Melting Point ]:
-37 °C

[ Molecular Formula ]:
C4H5ClO2

[ Molecular Weight ]:
120.53400

[ Flash Point ]:
39.7ºC

[ Exact Mass ]:
119.99800

[ PSA ]:
26.30000

[ LogP ]:
0.91190

[ Appearance of Characters ]:
Liquid | Clear colorless to slightly brown

[ Index of Refraction ]:
1.426

[ Storage condition ]:
0-6°C

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AS6380000
CHEMICAL NAME :
Acrylic acid, 2-chloro-, methyl ester
CAS REGISTRY NUMBER :
80-63-7
BEILSTEIN REFERENCE NO. :
1421536
LAST UPDATED :
199710
DATA ITEMS CITED :
12
MOLECULAR FORMULA :
C4-H5-Cl-O2
MOLECULAR WEIGHT :
120.54
WISWESSER LINE NOTATION :
1UYGVO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Human
DOSE/DURATION :
5 ppm
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - conjunctive irritation
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
500 mg/m3/2H
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Lungs, Thorax, or Respiration - dyspnea Gastrointestinal - changes in structure or function of salivary glands
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/m3/2H
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Lungs, Thorax, or Respiration - dyspnea Gastrointestinal - changes in structure or function of salivary glands
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
500 mg/m3/2H
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Lungs, Thorax, or Respiration - dyspnea Gastrointestinal - changes in structure or function of salivary glands
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
500 mg/m3/2H
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Lungs, Thorax, or Respiration - dyspnea Gastrointestinal - changes in structure or function of salivary glands
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
500 mg/m3/2H
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Lungs, Thorax, or Respiration - dyspnea Gastrointestinal - changes in structure or function of salivary glands
TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
400 mg/m3/2H/28D-I
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - structural or functional change in trachea or bronchi Lungs, Thorax, or Respiration - emphysema Related to Chronic Data - death
TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
400 mg/m3/2H/28D-I
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - structural or functional change in trachea or bronchi Lungs, Thorax, or Respiration - emphysema Related to Chronic Data - death
TYPE OF TEST :
TCLo - Lowest published toxic concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
400 mg/m3/2H/28D-I
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - structural or functional change in trachea or bronchi Lungs, Thorax, or Respiration - emphysema Related to Chronic Data - death

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
1 nmol/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 78,113,1980

Safety Information

[ Hazard Codes ]:
T+

[ Risk Phrases ]:
34-26-24/25-10

[ Safety Phrases ]:
S16;S26;S38;S45;S36/S37/S39

[ RIDADR ]:
UN 2927

[ Packaging Group ]:
II

[ Hazard Class ]:
6.1(a)

Synthetic Route

Precursor & DownStream

Precursor

  • Methyl 2,3-dichloropropanoate
  • methyl 3-bromo-2-chloropropanoate
  • Methyl 2,2-dichloropropanoate
  • Benzaldehyde
  • Trichloroethylene
  • dichloro-methylsulfanyl-acetic acid methyl ester
  • acrylic acid methyl ester
  • methyl 2-chloro-2-(phenylselanyl)propanoate

DownStream

  • Dimethyl 1H-pyrazole-3,5-dicarboxylate
  • trimethyl cyclopropane-1,1,2-tricarboxylate
  • UNII:FDN17EXK1J
  • UNII:FDN17EXK1J
  • 3,4-Dichlorobenzoic acid
  • Methyl-3-hydroxythiophen-2-carboxylat
  • methyl 3-acetylsulfanyl-2-chloro-propanoate
  • 2-(2-chloro-3-methoxy-3-oxopropyl)sulfanylacetic acid
  • methyl 2-chloro-3-methoxypropanoate
  • METHYL 2-PHENYLACRYLATE

Related Compounds

  • methyl alpha-D-6-(12-(9-anthroyl)stearoyl)glucoside
  • methyl alpha-methyl-4-morpholinepropionate
  • methyl alpha-[2-(aminocarbonyl)phenoxy]furan-2-acetate
  • methyl alpha-D-xylopyranoside
  • methyl alpha-ethylaziridine-1-acetate
  • methyl alpha-cyclohexylthiophen-2-acetate
  • tert-butyl N-[1-oxo-2-(2,3,4,5-tetrafluorophenyl)propan-2-yl]carbamate
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-{8-[(Benzyloxy)carbonyl]-8-azabicyclo[3.2.1]oct-2-en-3-yl}-2-methylpropanoic acid
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 1-methyl-3-[2-(thiophen-3-yl)ethyl]-1H-pyrazole-5-carboxylic acid
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde