3-[4-(5-Chloro-2-methoxyphenyl)phenyl]but-2-en-1-ol
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Basic information
- Standard SMILES
COc1ccc(Cl)cc1-c1ccc(C(C)=CCO)cc1- InChIKey
IOLXRVKALKZATN-UHFFFAOYSA-N- Molecular formula
- C17H17ClO2
- Average molar mass
- 288.8 g/mol
Names & identifiers
- Preferred name
- 3-[4-(5-Chloro-2-methoxyphenyl)phenyl]but-2-en-1-ol
- IUPAC
- 3-[4-(5-chloro-2-methoxyphenyl)phenyl]but-2-en-1-ol
Names & synonyms
SCHEMBL6492649
Database identifiers
- PubChem CID
- 69799845
Properties
Computed structural propertiesFilling in
- XLogP
- 4.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 321
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Related reactions
2 records
Compound notes
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