Basic information
- Standard SMILES
Cc1cccc(C(O)c2cnccn2)c1Br- InChIKey
VZXKONPWMCHQLJ-UHFFFAOYSA-N- Molecular formula
- C12H11BrN2O
- Average molar mass
- 279.13 g/mol
Names & identifiers
- Preferred name
- (2-Bromo-3-methylphenyl)(pyrazin-2-yl)methanol
- IUPAC
- (2-bromo-3-methylphenyl)-pyrazin-2-ylmethanol
Names & synonyms
1319197-08-4(2-bromo-3-methylphenyl)(pyrazin-2-yl)methanolSCHEMBL2228565VZXKONPWMCHQLJ-UHFFFAOYSA-NDA-12366
Database identifiers
- PubChem CID
- 67325817
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Related reactions
2 records
Compound notes
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