Basic information
- Standard SMILES
C=CCCOCc1ccc(C(=O)O)cc1- InChIKey
KIDVWJNCELPOPN-UHFFFAOYSA-N- Molecular formula
- C12H14O3
- Average molar mass
- 206.24 g/mol
Names & identifiers
- Preferred name
- 4-But-3-enyloxymethyl-benzoic acid
- IUPAC
- 4-(but-3-enoxymethyl)benzoic acid
Names & synonyms
SCHEMBL3312356KIDVWJNCELPOPN-UHFFFAOYSA-N4-But-3-enyloxymethyl-benzoic acid
Database identifiers
- PubChem CID
- 22136996
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Related reactions
15 records
Compound notes
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