Basic information
- CAS
18659-24-0- Standard SMILES
CNC(=O)Oc1ccc(C(C)C)cc1C- InChIKey
USQHVTMQSDIDMJ-UHFFFAOYSA-N- Molecular formula
- C12H17NO2
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.12592879
Names & identifiers
- Preferred name
- Carbamic acid, methyl-, o-cym-5-yl ester
- IUPAC
- (2-methyl-4-propan-2-ylphenyl) N-methylcarbamate
Names & synonyms
Carbamic acid, methyl-, o-cym-5-yl ester
Database identifiers
- CAS
18659-24-0- PubChem CID
- 87742
- DTXSID
DTXSID60940110
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 216
Experimental & physicochemical properties
LogP3.11
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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