CAS Number4630-82-4
SynonymsHexahydrobenzoic 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
Molecular FormulaC6H11CO2CH3
Molecular Weight142.20
Purity98%
Density1.0±0.1 g/cm3
Boiling Point183 °C (lit.)
Melting Point183ºC
Appearanceliquid
EINECS225-050-2
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 4630-82-4 |
| Catalog No. | 2A-9008276 |
| Chinese Name | 环己甲酸甲酯 |
| Synonyms | 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 |
| Molecular Formula | C6H11CO2CH3 |
| Molecular Weight | 142.20 |
| Purity | 98 |
| Density | 1.0±0.1 g/cm3 |
| Boiling Point | 183 °C (lit.) |
| Melting Point | 183ºC |
| Appearance | liquid |
| Water Solubility | ALMOST INSOLUBLE |
| Storage Condition | Keep away from light, ventilated and dry, sealed |
| Packaging | III |
| Application | Methyl cyclohexanecarboxylate is an endogenous metabolite. |
| EINECS | 225-050-2 |
| HTC | 2915130000 |
| UN(IATA) | UN 3272 |
| PubChem ID | 24851829 |
| MDL Number | MFCD00001458 |
| SMILES | COC(=O)C1CCCCC1 |
| InChI | 1S/C8H14O2/c1-10-8(9)7-5-3-2-4-6-7/h7H,2-6H2,1H3 |
| InChI Key | ZQWPRMPSCMSAJU-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | 3.2 |
| Safety Description | S24/25 |
| MSDS | msds/8276_1_4630_82_4.pdf |
| Bioactivity | Methyl cyclohexanecarboxylate is an endogenous metabolite. Related Catalog Research Areas >> Metabolic Disease Target Human Endogenous Metabolite 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 InChIKey ZQWPRMPSCMSAJU-UHFFFAOYSA-N SMILES COC(=O)C1CCCCC1 Water Solubility ALMOST INSOLUBLE |
| Use of | Methyl cyclohexanecarboxylate is an endogenous metabolite. Properties Name Methyl cyclohexanecarboxylate Synonym More Synonyms Methyl cyclohexanoate Biological Activity Description Methyl cyclohexanecarboxylate is an endogenous metabolite. Related Catalog Research Areas >> Metabolic Disease Human Endogenous Metabolite Chemical & Physical Properties Molecular Formula C8H14O2 Exact Mass 142.099380 PSA 26.30000 Index of Refraction 1.449 InChIKey ZQWPRMPSCMSAJU-UHFFFAOYSA-N Water Solubility ALMOST INSOLUBLE |
| Tax Rebate | 9.0% |
| Supervision | A. Customs clearance form for inbound goods B. Customs clearance form for outbound goods |
| Inspection | R. Imported food hygiene supervision and inspection S. Export food hygiene supervision and inspection M. Imported commodity inspection N. Exported commodity inspection |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Danger Regulations: 3272 International Maritime Transport Danger Regulations: 3272 International Air Transport Danger Regulations: 3272 14.2 United Nations shipping name European Land Transport Dangerous Regulations: ESTERS, N.O.S. (Methyl cyclohexanecarboxylate) IMDG Code: ESTERS, N.O.S. (Methyl cyclohexanecarboxylate) IMDG Code: Esters, n.o.s. (Methyl cyclohexanecarboxylate) 14.3 Transport hazard categories European land transport Dangerous Regulations: 3 International sea transport Dangerous Regulations: 3 International air transport Dangerous Regulations: 3 14.4 Package group European Land Transport Danger Regulations: III International Maritime Transport Danger Regulations: III International Air Transport Danger Regulations: III 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip. |
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