1-(p-Nitrobenzoyl)aziridine
Basic information
- CAS
19614-29-0- Standard SMILES
O=C(c1ccc([N+](=O)[O-])cc1)N1CC1- InChIKey
WUTHXPCLBWBKMP-UHFFFAOYSA-N- Molecular formula
- C9H8N2O3
- Average molar mass
- 192.17 g/mol
- Monoisotopic mass
- 192.05349212
Names & identifiers
- Preferred name
- 1-(p-Nitrobenzoyl)aziridine
- IUPAC
- aziridin-1-yl-(4-nitrophenyl)methanone
- English name
- 1-(p-Nitrobenzoyl)aziridine
- Molecular formula
- C9H8N2O3
- Molecular weight
- 192.17
Names & synonyms
1-(p-Nitrobenzoyl)aziridineN-(p-Nitrobenzoyl)aziridine1-(4-Nitrobenzoyl)aziridinep-NitrobenzoylethyleneimineAziridine, 1-(4-nitrobenzoyl)-AZIRIDINE, 1-(p-NITROBENZOYL)-19614-29-0AI3-50751Y72XXE9V6PNSC 50704BRN 0168173UNII-Y72XXE9V6P
Show more names
NSC-50704aziridin-1-yl-(4-nitrophenyl)methanoneNSC50704SCHEMBL9152022DTXSID301732761-Aziridinyl(4-nitrophenyl)methanone(Aziridin-1-yl)(4-nitrophenyl)methanoneMethanone, 1-aziridinyl(4-nitrophenyl)-
Database identifiers
- CAS
19614-29-0- PubChem CID
- 29679
- DTXSID
DTXSID30173276- UNII
- Y72XXE9V6P
- Nikkaji
- J35.244F
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 65.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- FDA UNII
- 72 XXE9V6P · Y72XXE9V6P
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Related reactions
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Compound notes
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