Basic information
- CAS
2631-30-3- Standard SMILES
CCc1ccc(OC(=O)NC)cc1- InChIKey
LPTHKTMCQQFAOH-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
- Monoisotopic mass
- 179.09462866
Names & identifiers
- Preferred name
- Phenol, 4-ethyl-, methylcarbamate
- IUPAC
- (4-ethylphenyl) N-methylcarbamate
Names & synonyms
2631-30-3Phenol, 4-ethyl-, methylcarbamatep-Ethylphenyl methylcarbamate4-Ethylphenyl methylcarbamateSCHEMBL9326256DTXSID80876028Carbamic acid, methyl-, p-ethylphenyl ester
Database identifiers
- CAS
2631-30-3- PubChem CID
- 75826
- DTXSID
DTXSID80876028- Nikkaji
- J747.735J
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
Experimental & physicochemical properties
LogP2.27
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…