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Basic information
- Standard SMILES
CC(C)Oc1cc(Br)cnc1CO- InChIKey
ZQXHLVMJONTTSB-UHFFFAOYSA-N- Molecular formula
- C9H12BrNO2
- Average molar mass
- 246.1 g/mol
Names & identifiers
- Preferred name
- (5-Bromo-3-isopropoxy-pyridin-2-yl)-methanol
- IUPAC
- (5-bromo-3-propan-2-yloxy-2-pyridinyl)methanol
Names & synonyms
SCHEMBL2067825ZQXHLVMJONTTSB-UHFFFAOYSA-NDS-018645(5-bromo-3-isopropoxy-pyridin-2-yl)-methanol1257431-88-1
Database identifiers
- PubChem CID
- 59612931
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Related reactions
3 records
Compound notes
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