2-(2-But-1-enylphenoxy)acetic acid
Basic information
- CAS
5456-50-8- Standard SMILES
CCC=Cc1ccccc1OCC(=O)O- InChIKey
SRYOZKVPPHUEPS-UHFFFAOYSA-N- Molecular formula
- C12H14O3
- Average molar mass
- 206.24 g/mol
- Monoisotopic mass
- 206.0942943
Names & identifiers
- Preferred name
- 2-(2-But-1-enylphenoxy)acetic acid
- IUPAC
- 2-(2-but-1-enylphenoxy)acetic acid
Database identifiers
- CAS
5456-50-8- PubChem CID
- 228528
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 223
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Compound notes
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