Methyl cyclohexanoate

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Names

[ CAS No. ]:
4630-82-4

[ Name ]:
Methyl cyclohexanoate

[Synonym ]:
Hexahydrobenzoic acid methyl ester
EINECS 225-050-2
MFCD00001458
Methyl cyclohexylformate
Cyclohexanecarboxylic acid methyl ester
methoxycarbonylcyclohexane
methyl cyclohexane-carboxylate
L6TJ AVO1
Cyclohexanecarboxylic acid, methyl ester
Methyl cyclohexylcarboxylate
Methyl cyclohexanecarboxylate
CYCLOHEXANECARBOXYLIC ACID,METHYL ESTER
Methyl cyclohexanoate
Methyl hexahydrobenzoate

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
183.0±0.0 °C at 760 mmHg

[ Melting Point ]:
183ºC

[ Molecular Formula ]:
C8H14O2

[ Molecular Weight ]:
142.196

[ Flash Point ]:
60.0±0.0 °C

[ Exact Mass ]:
142.099380

[ PSA ]:
26.30000

[ LogP ]:
2.24

[ Vapour Pressure ]:
0.8±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.449

[ Water Solubility ]:
ALMOST INSOLUBLE

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GU8599000
CHEMICAL NAME :
Cyclohexanecarboxylic acid, methyl ester
CAS REGISTRY NUMBER :
4630-82-4
BEILSTEIN REFERENCE NO. :
1306359
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H14-O2
MOLECULAR WEIGHT :
142.22
WISWESSER LINE NOTATION :
L6TJ AVO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3881 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DCTODJ Drug and Chemical Toxicology. (Marcel Dekker, 270 Madison Ave., New York, NY 10016) V.1- 1977/78- Volume(issue)/page/year: 3,249,1980

Safety Information

[ Symbol ]:

GHS02

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H226

[ Personal Protective Equipment ]:
Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S24/25

[ RIDADR ]:
UN 3272 3/PG 3

[ WGK Germany ]:
2

[ RTECS ]:
GU8599000

[ Packaging Group ]:
III

[ Hazard Class ]:
3.2

[ HS Code ]:
2915130000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Methyl benzoate
  • methyl formate
  • Cyclohexene
  • Methanol
  • Cyclohexanecarboxaldehyde
  • TMOS
  • Cyclohexylmethanol
  • Cyclohexanecarboxylic acid
  • carbon monoxide
  • Cyclohexane, iodo-

DownStream

  • Methyl 1-(hydroxyMethyl)cyclohexanecarboxylate
  • Ethyl hexahydrobenzoate
  • Cyclohexanecarboxylicacid, hydrazide
  • Methyl trifluoroacetate
  • Cyclohexanecarboxylic acid
  • (1,1-2H2)Ethanol
  • Cyclohexanol
  • 1-Cyclohexylethan-1-one
  • Cyclohexanecarboxaldehyde
  • Diethyl methylphosphonate

Customs

[ HS Code ]: 2916209090

[ Summary ]:
2916209090 other cyclanic, cyclenic or cyclotherpenic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • Methyl 2-hydroxy-2-(trifluoromethyl)-4-pentynoate
  • methyl 3-azido-2-methylidenehexanoate
  • methyl 3-azido-4-methyl-2-methylidenehexanoate
  • methyl 4-bromo-5-hydroxyhexanoate
  • methyl (3S)-3-hydroxy-5-methylhexanoate
  • methyl 6-(2-hydroxyethoxy)hexanoate
  • 1-(2-(2-(2-Methoxyethoxy)ethoxy)ethyl)-1H-indole-5,6-diol
  • 2-Chloro-4-phenoxy-7H-pyrrolo[2,3-d]pyrimidine
  • Kadcoccinone E
  • 2-(2,6-Dimethoxyphenyl)-3-(diphenylphosphino)-1-methyl-1H-indole
  • Methyl 3-amino-4-(1-(2-(methoxycarbonyl)phenyl)ethyl)benzoate
  • Methyl 2-iodo-1-naphthoate
  • 1-(4-Cyclopropyl-2-fluorophenyl)ethan-1-one
  • Methyl 2-(3-bromophenyl)-3-formamidopropanoate
  • N-Ethyl-N-(2-propoxyphenyl)acetamide
  • 2-Chloro-4-triphenylen-2-ylpyrimidine
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