2-Hydroxy-3-nitrocarbazole
Completing data — refresh the page later to see the latest
Basic information
- CAS
153654-33-2- Standard SMILES
O=[N+]([O-])c1cc2c(cc1O)[nH]c1ccccc12- InChIKey
AFYFSKQCEUFIJU-UHFFFAOYSA-N- Molecular formula
- C12H8N2O3
- Average molar mass
- 228.2 g/mol
- Monoisotopic mass
- 228.05349212
Names & identifiers
- Preferred name
- 2-Hydroxy-3-nitrocarbazole
- IUPAC
- 3-nitro-9H-carbazol-2-ol
- English name
- 2-HYDROXY-3-NITROCARBAZOLE
- Molecular formula
- C12H8N2O3
- Molecular weight
- 228.2
Names & synonyms
2-Hydroxy-3-nitrocarbazole3-nitro-9H-carbazol-2-ol153654-33-2CCRIS 6774MPH8F69T2P9H-Carbazol-2-ol, 3-nitro-DTXSID50165390RefChem:87399DTXCID3087881UNII-MPH8F69T2P
Database identifiers
- CAS
153654-33-2- PubChem CID
- 5488464
- DTXSID
DTXSID50165390- UNII
- MPH8F69T2P
- Nikkaji
- J2.039.924D
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 81.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 317
Physicochemical properties
- Boiling point
- 463.1 · 463.1±25.0 °C(Predicted)
- Density
- 1.56 · 1.560±0.06 g/cm3(Predicted)
- pka
- 7.36 · 7.36±0.30(Predicted)
- FDA UNII
- 8 F69T2P · MPH8F69T2P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…