Basic information
- CAS
6975-57-1- Standard SMILES
CCC(OC(=O)N(C)C)c1ccccc1- InChIKey
IDTXPNIILSVALZ-UHFFFAOYSA-N- Molecular formula
- C12H17NO2
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.12592879
Names & identifiers
- Preferred name
- 1-phenylpropyl N,N-dimethylcarbamate
- IUPAC
- 1-phenylpropyl N,N-dimethylcarbamate
- English name
- 1-phenylpropyl N,N-dimethylcarbamate
- Molecular formula
- C12H17NO2
- Molecular weight
- 207.27
Names & synonyms
6975-57-11-phenylpropyl N,N-dimethylcarbamate1-phenylpropyl dimethylcarbamateNSC24181DTXSID10282092NSC-24181Carbamic acid, N,N-dimethyl-, 1-phenylpropyl ester
Database identifiers
- CAS
6975-57-1- PubChem CID
- 229997
- DTXSID
DTXSID10282092
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 198
Physicochemical properties
- Boiling point
- 284.4 · 284.4±10.0 °C(Predicted)
- Density
- 1.037 · 1.037±0.06 g/cm3(Predicted)
- pka
- -1.39 · -1.39±0.70(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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