Basic information
- Standard SMILES
CC(C)=CC(SC(C=C(C)C)c1ccccc1)c1ccccc1- InChIKey
YNVGGCASKMBSKC-UHFFFAOYSA-N- Molecular formula
- C22H26S
- Average molar mass
- 322.5 g/mol
Names & identifiers
- Preferred name
- Phenyl-3-methylbut-2-enylsulfide
- IUPAC
- [3-methyl-1-(3-methyl-1-phenylbut-2-enyl)sulfanylbut-2-enyl]benzene
Names & synonyms
SCHEMBL4313730phenyl-3-methylbut-2-enylsulfideYNVGGCASKMBSKC-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 54518102
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 348
Related reactions
12 records
Linked notes
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