Basic information
- CAS
49839-35-2- Standard SMILES
CN(C(=O)Oc1ccc([N+](=O)[O-])cc1)c1ccccc1- InChIKey
LXZKDOSRDVBNCF-UHFFFAOYSA-N- Molecular formula
- C14H12N2O4
- Average molar mass
- 272.26 g/mol
- Monoisotopic mass
- 272.07970687
Names & identifiers
- Preferred name
- 4-Nitrophenyl methylphenylcarbamic acid
- IUPAC
- (4-nitrophenyl) N-methyl-N-phenylcarbamate
Names & synonyms
49839-35-24-Nitrophenyl methylphenylcarbamic acid4-nitrophenyl methyl(phenyl)carbamate(4-nitrophenyl) N-methyl-N-phenyl-carbamate(4-nitrophenyl) N-methyl-N-phenylcarbamateHMS2527D24Cambridge id 7168195MLS000676834SCHEMBL5685316CHEMBL1400844DTXSID30198106LXZKDOSRDVBNCF-UHFFFAOYSA-N
Show more names
N-methyl(4-nitrophenoxy)-N-benzamideAKOS002245458NCGC00245657-01SMR000271844DB-412904ST50487052methyl-phenyl-carbamic acid 4-nitro-phenyl esterAS-871/41376150
Database identifiers
- CAS
49839-35-2- PubChem CID
- 39556
- DTXSID
DTXSID30198106- ChEMBL
CHEMBL1400844- Nikkaji
- J1.074.391E
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 342
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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