4-(4-Hydroxymethylphenyl)butan-2-ol
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Basic information
- Standard SMILES
CC(O)CCc1ccc(CO)cc1- InChIKey
WDOCMVHHWFVKEL-UHFFFAOYSA-N- Molecular formula
- C11H16O2
- Average molar mass
- 180.24 g/mol
Names & identifiers
- Preferred name
- 4-(4-Hydroxymethylphenyl)butan-2-ol
- IUPAC
- 4-[4-(hydroxymethyl)phenyl]butan-2-ol
Names & synonyms
SCHEMBL1627967WDOCMVHHWFVKEL-UHFFFAOYSA-N4-(4-hydroxymethylphenyl)butan-2-ol4-(4-hydroxymethyl-phenyl)butan-2-ol
Database identifiers
- PubChem CID
- 67100136
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 128
Related reactions
9 records
Compound notes
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