2-Nitrophenyl N-methylcarbamate
Basic information
- CAS
7374-06-3- Standard SMILES
CNC(=O)Oc1ccccc1[N+](=O)[O-]- InChIKey
WROWUHCAAFNMJL-UHFFFAOYSA-N- Molecular formula
- C8H8N2O4
- Average molar mass
- 196.16 g/mol
- Monoisotopic mass
- 196.04840674
Names & identifiers
- Preferred name
- 2-Nitrophenyl N-methylcarbamate
- IUPAC
- (2-nitrophenyl) N-methylcarbamate
- English name
- N-Methylcarbamic acid 2-nitrophenyl ester
- Molecular weight
- 0
Names & synonyms
2-Nitrophenyl N-methylcarbamateo-Nitrophenyl N-methylcarbamateo-Nitrophenyl methylcarbamateTL-9977374-06-3Carbamic acid, N-methyl-, 2-nitrophenyl ester7LQD7G852XCarbamic acid, methyl-, 2-nitrophenyl esterCarbamic acid, methyl-, o-nitrophenyl esterNSC-128174CARBAMIC ACID, N-METHYL-, o-NITROPHENYL ESTERRefChem:1063936
Show more names
N-Methylcarbamic acid 2-nitrophenyl ester
Methylcarbamic ester of 2-nitrophenolAR-2NSC 128174BRN 2214975WLN: WNR BOVM1UNII-7LQD7G852X2-Nitrophenyl methylcarbamateSCHEMBL3640979
Database identifiers
- CAS
7374-06-3- PubChem CID
- 23840
- DTXSID
DTXSID70879381- ChEMBL
CHEMBL3249284- UNII
- 7LQD7G852X
- Nikkaji
- J42.911B
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
Experimental & physicochemical properties
LogP1.02
Physicochemical properties
- FDA UNII
- 7 LQD7G852X · 7LQD7G852X
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Related reactions
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Compound notes
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