(4-nitrophenyl)methyl N-(4-butylphenyl)carbamate
Basic information
- CAS
883808-30-8- Standard SMILES
CCCCc1ccc(NC(=O)OCc2ccc([N+](=O)[O-])cc2)cc1- InChIKey
AFOYZHGIZCAAKC-UHFFFAOYSA-N- Molecular formula
- C18H20N2O4
- Average molar mass
- 328.4 g/mol
- Monoisotopic mass
- 328.14230712
Names & identifiers
- Preferred name
- (4-nitrophenyl)methyl N-(4-butylphenyl)carbamate
- IUPAC
- (4-nitrophenyl)methyl N-(4-butylphenyl)carbamate
Names & synonyms
(4-nitrophenyl)methyl N-(4-butylphenyl)carbamateAKOS024343397ST50562008(4-BUTYL-PHENYL)-CARBAMIC ACID 4-NITRO-BENZYL ESTER
Database identifiers
- CAS
883808-30-8- PubChem CID
- 4129366
- EC Number
- 163-890-0
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 394
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