Basic information
- Standard SMILES
CCOC(=O)c1ccc(C=C(C)c2cc3c(s2)C(C)(C)CCC3(C)C)cc1- InChIKey
BESWYHANHFYRGN-UHFFFAOYSA-N- Molecular formula
- C24H30O2S
- Average molar mass
- 382.6 g/mol
Names & identifiers
- Preferred name
- Ethyl p-[2-(4,5,6,7-tetrahydro-4,4,7,7-tetramethylbenzo[b]thien-2-yl)propenyl]-benzoate
- IUPAC
- ethyl 4-[2-(4,4,7,7-tetramethyl-5,6-dihydro-1-benzothiophen-2-yl)prop-1-enyl]benzoate
Names & synonyms
SCHEMBL7225290BESWYHANHFYRGN-UHFFFAOYSA-Nethyl p-[2-(4,5,6,7-tetrahydro-4,4,7,7-tetramethylbenzo[b]thien-2-yl)propenyl]-benzoateethyl p-[2-(4,5,6,7-tetrahydro-4,4,7,7-tetramethylbenzo[b]thien-2-yl)propenyl]benzoate
Database identifiers
- PubChem CID
- 53678243
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 569
Related reactions
10 records
Compound notes
Loading…