[5-(4-Hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3-methylpent-2-en-4-ynyl]-triphenylphosphanium

HCID 73629969
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C#CC1=C(C)CC(O)CC1(C)C)=CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChIKey
PAZJYGWOIBJTHS-UHFFFAOYSA-N
Molecular formula
C33H36OP+
Average molar mass
479.6 g/mol

Names & identifiers

Preferred name
[5-(4-Hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3-methylpent-2-en-4-ynyl]-triphenylphosphanium
IUPAC
[5-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-3-methylpent-2-en-4-ynyl]-triphenylphosphanium

Database identifiers

PubChem CID
73629969

Properties

Computed structural properties

XLogP
7.3
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
7
Heavy atoms
35

Related reactions

1 records
New reaction record

Compound notes

Loading…