Basic information
- CAS
446830-51-9- Standard SMILES
O=Cc1nc(-c2cccc([N+](=O)[O-])c2)n2ccccc12- InChIKey
QSMKOSLIGQUWDF-UHFFFAOYSA-N- Molecular formula
- C14H9N3O3
- Average molar mass
- 267.24 g/mol
- Monoisotopic mass
- 267.06439116
Names & identifiers
- Preferred name
- 3-(3-Nitrophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
- IUPAC
- 3-(3-nitrophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
- English name
- 3-(3-Nitro-phenyl)-imidazo[1,5-a]pyridine-1-carbaldehyde
- Molecular formula
- C14H9N3O3
- Molecular weight
- 267.24
Names & synonyms
446830-51-93-(3-nitrophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde3-(3-NITRO-PHENYL)-IMIDAZO[1,5-A]PYRIDINE-1-CARBALDEHYDE3-{3-nitrophenyl}imidazo[1,5-a]pyridine-1-carbaldehydeOprea1_241296Oprea1_870724DTXSID00351201AKOS000808031AB12975DB-070583CS-0323127ST50037066
Show more names
Imidazo[1,5-a]pyridine-1-carboxaldehyde, 3-(3-nitrophenyl)-
AF-399/40841444SR-01000262370SR-01000262370-13-(3-nitrophenyl)-4-hydroimidazo[1,5-a]pyridinecarbaldehyde
Database identifiers
- CAS
446830-51-9- PubChem CID
- 693247
- DTXSID
DTXSID00351201
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 80.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 384
Physicochemical properties
- Density
- 1.4 · 1.40±0.1 g/cm3(Predicted)
- pka
- 2.18 · 2.18±0.30(Predicted)
Chemistry & industry
Suppliers1 total
上海智乾生物科技有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…