cyclohexyl N-phenylcarbamate
Basic information
- CAS
3770-95-4- Standard SMILES
O=C(Nc1ccccc1)OC1CCCCC1- InChIKey
CEUNIYVZFAQQSI-UHFFFAOYSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- cyclohexyl N-phenylcarbamate
- IUPAC
- cyclohexyl N-phenylcarbamate
- English name
- Cyclohexyl carbanilate
- Molecular formula
- C13H17NO2
- Molecular weight
- 219.28
Names & synonyms
cyclohexyl N-phenylcarbamateRefChem:580818700-385-1cyclohexyl phenylcarbamate3770-95-4CYCLOHEXYL CARBANILATENSC59905cyclohexylphenylcarbamateEnamine_005873SCHEMBL2576912URB602, 3bBDBM81312
Show more names
NSC 59905Cyclohexanol carbanilateO-cyclohexyl N-phenylcarbamatePhenylcarbamic acid cyclohexyl esterCarbamic acid, N-phenyl-, cyclohexyl ester
DTXSID10289228CEUNIYVZFAQQSI-UHFFFAOYSA-NHMS1410K21NSC-59905AKOS001021946EBC-612361IDI1_008108Carbamic acid, phenyl-, cyclohexyl ester
Database identifiers
- CAS
3770-95-4- PubChem CID
- 246597
- DTXSID
DTXSID10289228- EC Number
- 700-385-1
- Nikkaji
- J594.823A
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 218
Experimental & physicochemical properties
SpringerMaterials PropertiesDiamagnetic susceptibility
Physicochemical properties
- Melting point
- 85 · 85-86℃
- Boiling point
- 296 ℃ · 296℃
- Density
- 1.1 · 1.10
- Flash point
- 113 ℃ · 113℃
- storage temp.
- 2 · 2-8°C
- Cosmetics Ingredients Functions
- SKIN CONDITIONING
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
2 records
Compound notes
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