Basic information
- Standard SMILES
N#CC1(c2cccc(Br)c2)CC(O)C1- InChIKey
GOJZHSIYKOCRQF-UHFFFAOYSA-N- Molecular formula
- C11H10BrNO
- Average molar mass
- 252.11 g/mol
Names & identifiers
- Preferred name
- 1-(3-bromophenyl)-3-hydroxyCyclobutanecarbonitrile
- IUPAC
- 1-(3-bromophenyl)-3-hydroxycyclobutane-1-carbonitrile
Names & synonyms
1357924-34-51-(3-bromophenyl)-3-hydroxycyclobutane-1-carbonitrile1-(3-bromophenyl)-3-hydroxyCyclobutanecarbonitrileSCHEMBL571927GOJZHSIYKOCRQF-UHFFFAOYSA-NAKOS015331152AT41200DA-11474
Database identifiers
- PubChem CID
- 65989072
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 264
Related reactions
1 records
Compound notes
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