Carbamic acid, methyl-, 3-phenylpropyl ester
Basic information
- CAS
91246-86-5- Standard SMILES
CNC(=O)OCCCc1ccccc1- InChIKey
WKXXZMRDOKUKHG-UHFFFAOYSA-N- Molecular formula
- C11H15NO2
- Average molar mass
- 193.24 g/mol
- Monoisotopic mass
- 193.11027872
Names & identifiers
- Preferred name
- Carbamic acid, methyl-, 3-phenylpropyl ester
- IUPAC
- 3-phenylpropyl N-methylcarbamate
Names & synonyms
Benzenepropanol, methylcarbamateMethylcarbamic acid 3-phenylpropyl esterCARBAMIC ACID, METHYL-, 3-PHENYLPROPYL ESTERMH 663BRN 210947291246-86-5DTXSID50238457RefChem:332545DTXCID701609483-Phenylpropyl methylcarbamateSCHEMBL4922134
Database identifiers
- CAS
91246-86-5- PubChem CID
- 56203
- DTXSID
DTXSID50238457
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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