3-Nitroso-2-phenylimidazo[1,2-a]pyridine
Basic information
- CAS
3672-37-5- Standard SMILES
O=Nc1c(-c2ccccc2)nc2ccccn12- InChIKey
HYFJUZQWWMWFQT-UHFFFAOYSA-N- Molecular formula
- C13H9N3O
- Average molar mass
- 223.23 g/mol
- Monoisotopic mass
- 223.07456192
Overview
3-nitroso-2-phenylimidazo[1,2-a]pyridine is a member of the class of imidazopyridines that is imidazo[1,2-a]pyridine substituted at positions 2 and 3 by phenyl and nitroso groups respectively. It is a nitroso compound and an imidazopyridine.
Names & identifiers
- Preferred name
- 3-Nitroso-2-phenylimidazo[1,2-a]pyridine
- IUPAC
- 3-nitroso-2-phenylimidazo[1,2-a]pyridine
- English name
- 3-Nitroso-2-phenyl-imidazo[1,2-a]pyridine
- Molecular formula
- C13H9N3O
- Molecular weight
- 223.23
Names & synonyms
3-nitroso-2-phenylimidazo[1,2-a]pyridine3672-37-53-nitroso-2-phenyl-imidazo[1,2-a]pyridineMFCD00441388Imidazo(1,2-a)pyridine, 3-nitroso-2-phenyl-NSC369059NSC 3690593CGX4QK107NSC-3690593-Nitroso-2-phenylimidazo(1,2-a)pyridineImidazo[1,2-a]pyridine, 3-nitroso-2-phenyl-UNII-3CGX4QK107
Show more names
SCHEMBL3791465NIOSH/NJ5787000CHEBI:78038HYFJUZQWWMWFQT-UHFFFAOYSA-DTXSID70190184STL417059AKOS0004166153-nitroso-2-phenyl imidazo[1,2-a]pyridine
Database identifiers
- CAS
3672-37-5- PubChem CID
- 339977
- DTXSID
DTXSID70190184- ChEBI
CHEBI:78038- UNII
- 3CGX4QK107
- Nikkaji
- J1.600.687D
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 46.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 278
Physicochemical properties
- FDA UNII
- 3 CGX4QK107 · 3CGX4QK107
Chemistry & industry
Additional notes
DefinitionChEBI: A member of the class of imidazopyridines that is imidazo[1,2-a]pyridine substituted at positions 2 and 3 by phenyl and nitroso groups respectively.
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Related reactions
1 records
Compound notes
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