4-(Benzyloxy)phenyl 2-fluoro-5-nitrophenylcarbamate
Basic information
- CAS
195140-90-0- Standard SMILES
O=C(Nc1cc([N+](=O)[O-])ccc1F)Oc1ccc(OCc2ccccc2)cc1- InChIKey
TVLDFBSQHVYDKT-UHFFFAOYSA-N- Molecular formula
- C20H15FN2O5
- Average molar mass
- 382.3 g/mol
- Monoisotopic mass
- 382.09649975
Names & identifiers
- Preferred name
- 4-(Benzyloxy)phenyl 2-fluoro-5-nitrophenylcarbamate
- IUPAC
- (4-phenylmethoxyphenyl) N-(2-fluoro-5-nitrophenyl)carbamate
- English name
- 4-(Benzyloxy)phenyl N-(2-fluoro-5-nitrophenyl)carbamate
- Molecular formula
- C20H15FN2O5
- Molecular weight
- 382.34
Names & synonyms
NSC2040714-(benzyloxy)phenyl 2-fluoro-5-nitrophenylcarbamateDTXSID101150847AKOS024433772NSC-204071195140-90-04-(Benzyloxy)phenyl (2-fluoro-5-nitrophenyl)carbamateCarbamic acid, (2-fluoro-5-nitrophenyl)-, 4-(phenylmethoxy)phenyl ester4-(Benzyloxy)phenyl N-(2-fluoro-5-nitrophenyl)carbamate
Database identifiers
- CAS
195140-90-0- PubChem CID
- 306392
- DTXSID
DTXSID101150847
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 515
Physicochemical properties
- Boiling point
- 509.263 · 509.263±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.39 · 1.390±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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