2-(3-hydroxy-3,7,11,15-tetramethylhexadecyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione

CAS: 72657-56-8

Molecular Formula	`C29H50O3`
Molecular Weight	446.7 g/mol
LogP	8.8
Topological Polar Surface Area	54.4 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	15
Exact Mass	446.376
Heavy Atoms	32
Complexity	697.0

Chemical Identifiers

CAS Number	72657-56-8
SMILES	`CC1=C(C(=O)C(=C(C1=O)C)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O)C`
InChIKey	`LTVDFSLWFKLJDQ-UHFFFAOYSA-N`

📖 Product Overview

2-(3-hydroxy-3,7,11,15-tetramethylhexadecyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione (CAS: 72657-56-8) is a chemical compound with molecular formula C29H50O3 and molecular weight 446.7 g/mol. Its IUPAC systematic name is 2-(3-hydroxy-3,7,11,15-tetramethylhexadecyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione. LogP 8.8 Topological Polar Surface Area 54.4 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 15 Exact Mass 446.376 Heavy Atoms 32 Complexity 697.0 InChI Key: LTVDFSLWFKLJDQ-UHFFFAOYSA-N. SMILES: CC1=C(C(=O)C(=C(C1=O)C)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O)C.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 2-(3-hydroxy-3,7,11,15-tetramethylhexadecyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione.

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