Basic information
- CAS
5748-26-5- Standard SMILES
CC(C)C(=O)N(C)C(=O)Oc1cccc(C(C)C)c1- InChIKey
PNBLZGHZVYLIMX-UHFFFAOYSA-N- Molecular formula
- C15H21NO3
- Average molar mass
- 263.33 g/mol
- Monoisotopic mass
- 263.15214353
Names & identifiers
- Preferred name
- 3-(Propan-2-yl)phenyl methyl(2-methylpropanoyl)carbamate
- IUPAC
- (3-propan-2-ylphenyl) N-methyl-N-(2-methylpropanoyl)carbamate
- English name
- N-Methyl-N-(1-oxo-2-methylpropyl)carbamic acid 3-(1-methylethyl)phenyl ester
- Molecular formula
- C15H21NO3
- Molecular weight
- 263.33
Names & synonyms
5748-26-5DTXSID709730103-(propan-2-yl)phenyl methyl(2-methylpropanoyl)carbamateRefChem:1067229DTXCID801400469OMS-978Carbamic acid, isobutyrylmethyl-, m-cumenyl ester3-Isopropylphenyl N-isobutyryl-N-methylcarbamateCarbamic acid, methyl(2-methyl-1-oxopropyl)-, 3-(1-methylethyl)phenyl esterN-Methyl-N-(1-oxo-2-methylpropyl)carbamic acid 3-(1-methylethyl)phenyl esterCarbamic acid, methyl(2-methyl-1-oxopropyl)-, 3-(1-methylethyl)phenyl ester (9CI)
Database identifiers
- CAS
5748-26-5- PubChem CID
- 79822
- DTXSID
DTXSID70973010- Nikkaji
- J55.512F
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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