2-nonen-4-one

Compound Structure:

Synonyms:

(E)-2-Nonen-4-one;2-Nonen-4-one;non-2-en-4-one;2-Nonenone-4;2-Nonen-4-one, (2E)-;(E)-non-2-en-4-one;trans-2-Nonen-4-one;32064-72-5;27743-70-0;2-Nonen-4-one, (E)-;trans-2-Nonen-4-one [FHFI];(2E)-2-Nonen-4-one;

Compound ID:

NMPC-273

PubChem ID:

448996

Molecular Formula:

C9H16O

Canonical SMILES:

CCCCCC(=O)C=CC

InChIKey:

WTAYWTBOEQYGOG-QPJJXVBHSA-N

About the compound:

GHS Hazard Statements

Not Classified

Reported as not meeting GHS hazard criteria by 11 of 11 companies. For more detailed information, please visit ECHA C&L website.

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	140.22 g/mol
XLogP3-AA	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	140.120115130 g/mol
Monoisotopic Mass	140.120115130 g/mol
Topological Polar Surface Area	17.1Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	114
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes
Physical Description	Clear colourless or pale yellow liquid; Fruity aroma
Density	0.855-0.859
Solubility	Sparingly soluble in water; soluble in non-polar solvents

Source: PubChem

Source Species:

Prosopis africana

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