Basic information
- Standard SMILES
O=C(O)CCCCCCCCCC#CC#Cc1ccco1- InChIKey
CZUVYZZIHVPDAW-UHFFFAOYSA-N- Molecular formula
- C18H22O3
- Average molar mass
- 286.4 g/mol
Names & identifiers
- Preferred name
- 14-(Furan-2-yl)tetradeca-11,13-diynoic acid
- IUPAC
- 14-(furan-2-yl)tetradeca-11,13-diynoic acid
Names & synonyms
SCHEMBL1044434CZUVYZZIHVPDAW-UHFFFAOYSA-N14-(furan-2-yl)tetradeca-11,13-diynoic acid
Database identifiers
- PubChem CID
- 50898713
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 426
Related reactions
2 records
Compound notes
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