9H-Carbazole, 3-nitro-9-nitroso-
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Basic information
- CAS
5393-41-9- Standard SMILES
O=Nn1c2ccccc2c2cc([N+](=O)[O-])ccc21- InChIKey
UTBGPZHMURQBBF-UHFFFAOYSA-N- Molecular formula
- C12H7N3O3
- Average molar mass
- 241.2 g/mol
- Monoisotopic mass
- 241.04874109
Names & identifiers
- Preferred name
- 9H-Carbazole, 3-nitro-9-nitroso-
- IUPAC
- 3-nitro-9-nitrosocarbazole
- English name
- 3-Nitro-9-nitroso-9H-carbazole
- Molecular formula
- C12H7N3O3
- Molecular weight
- 241.2
Names & synonyms
5393-41-99H-Carbazole, 3-nitro-9-nitroso-Carbazole, 3-nitro-9-nitroso-NSC 4702NSC 67707DTXSID9063827RefChem:549933DTXCID80415393-Nitro-9-nitrosocarbazole3-Nitro-9-nitroso-9H-carbazoleNSC-4702NSC-67707
Show more names
UF5VEC9NWR3-Nitro-o-nitrosocarbazoleN-nitroso-3-nitrocarbazole3-nitro-9-nitroso-carbazoleCHEMBL1994729SCHEMBL15753214NSC4702UTBGPZHMURQBBF-UHFFFAOYSA-N
Database identifiers
- CAS
5393-41-9- PubChem CID
- 79363
- DTXSID
DTXSID9063827- ChEMBL
CHEMBL1994729- UNII
- UF5VEC9NWR
- Nikkaji
- J421.763B
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 80.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 357
Physicochemical properties
- Melting point
- 162 · 162-166 °C(Solv: acetone (67-64-1))
- Boiling point
- 459.4 · 459.4±37.0 °C(Predicted)
- Density
- 1.52 · 1.52±0.1 g/cm3(Predicted)
- FDA UNII
- 5 VEC9NWR · UF5VEC9NWR
- EPA Substance Registry System
- 9 H-Carbazole, · 9H-Carbazole, 3-nitro-9-nitroso- (5393-41-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9H-Carbazole, 3-nitro-9-nitroso-: INACTIVE
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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