Basic information
- Standard SMILES
C#CCOC(=O)c1ccc(OCC#C)c(OC)c1- InChIKey
ZTDDLEYHCPWOKA-UHFFFAOYSA-N- Molecular formula
- C14H12O4
- Average molar mass
- 244.24 g/mol
Names & identifiers
- Preferred name
- 2-Propynyl 4-(2-propynyloxy)-3-methoxybenzoate
- IUPAC
- prop-2-ynyl 3-methoxy-4-prop-2-ynoxybenzoate
Names & synonyms
SCHEMBL2282278ZTDDLEYHCPWOKA-UHFFFAOYSA-N2-propynyl 4-(2-propynyloxy)-3-methoxybenzoate
Database identifiers
- PubChem CID
- 59301765
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 370
Related reactions
7 records
Compound notes
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