Basic information
- Standard SMILES
CC(C=CC1=C(C)CC(O)CC1(C)C)=CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
CLSHILBUUPPOFW-UHFFFAOYSA-M- Molecular formula
- C33H38ClOP
- Average molar mass
- 517.1 g/mol
Names & identifiers
- Preferred name
- [5-(4-Hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl)-3-methyl-2,4-pentadienyl]triphenylphosphonium chloride
- IUPAC
- [5-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3-methylpenta-2,4-dienyl]-triphenylphosphanium chloride
Names & synonyms
SCHEMBL7845878CLSHILBUUPPOFW-UHFFFAOYSA-M[5-(4-hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl)-3-methyl-2,4-pentadienyl]triphenylphosphonium chloride[5-(4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-3-methyl-2,4-pentadienyl]triphenylphosphonium chloride
Database identifiers
- PubChem CID
- 73090609
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 723
Related reactions
2 records
Compound notes
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