4-Nonanol 2, 6, 8 trimethyl-a

Compound Structure:

Synonyms:

2,6,8-Trimethyl-4-nonanol;123-17-1;2,6,8-Trimethylnonan-4-ol;4-NONANOL, 2,6,8-TRIMETHYL-;4-Hydroxy-2,6,8-trimethylnonane;2,6,8-Trimethylnonanol-4;2,4,8-Trimethyl-6-nonanol

Compound ID:

NMPC-428

PubChem ID:

61056

Molecular Formula:

C12H26O

Canonical SMILES:

CC(C)CC(C)CC(CC(C)C)O

InChIKey:

LFEHSRSSAGQWNI-UHFFFAOYSA-N

About the compound:

GHS Hazard Statements

• H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	186.33 g/mol
XLogP3-AA	4.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	6
Exact Mass	186.198365449 g/mol
Monoisotopic Mass	186.198365449 g/mol
Topological Polar Surface Area	20.2Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	118
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes
Physical Description	Liquid

Source: PubChem

Source Species:

Anacardium occidentale
Annona senegalensis

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