Basic information
- CAS
701913-51-1- Standard SMILES
O=[N+]([O-])/C=C/c1cnc2ccccc2c1- InChIKey
YIBJFRUTOAWUEF-AATRIKPKSA-N- Molecular formula
- C11H8N2O2
- Average molar mass
- 200.19 g/mol
Names & identifiers
- Preferred name
- (E)-3-(2-nitrovinyl)quinoline
- IUPAC
- 3-[(E)-2-nitroethenyl]quinoline
- English name
- Quinoline, 3-[(1E)-2-nitroethenyl]- (9CI)
- Molecular formula
- C11H8N2O2
- Molecular weight
- 200.19
Names & synonyms
701913-51-1(E)-3-(2-nitrovinyl)quinoline3-(2-NITROETHENYL)QUINOLINE3-[(E)-2-Nitrovinyl]quinolineCHEMBL6172035EN300-1842308Quinoline, 3-[(1E)-2-nitroethenyl]-Quinoline, 3-[(1E)-2-nitroethenyl]- (9CI)
Database identifiers
- CAS
701913-51-1- ChEMBL
CHEMBL6172035
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 260
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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