ChemicalBook--->CAS DataBase List--->18402-83-0

18402-83-0

18402-83-0 Structure

18402-83-0 Structure
IdentificationBack Directory
[Name]

3-NONEN-2-ONE
[CAS]

18402-83-0
[Synonyms]

FEMA 3955
3-Nonenone
3-None-2-one
(E)-3-Nonen-2-one
(E)-Non-3-en-2-one
TRANS-3-NONEN-2-ONE
3-Nonen-2-one, (3E)-
trans-3-Nonen-2-one 95%
[EINECS(EC#)]

813-141-5
[Molecular Formula]

C9H16O
[MDL Number]

MFCD00010241
[MOL File]

18402-83-0.mol
[Molecular Weight]

140.22
Chemical PropertiesBack Directory
[Boiling point ]

85 °C12 mm Hg(lit.)
[density ]

0.848 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.449(lit.)
[Fp ]

179 °F
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Oil
[color ]

Clear Colourless
[InChI]

1S/C9H16O/c1-3-4-5-6-7-8-9(2)10/h7-8H,3-6H2,1-2H3/b8-7+
[InChIKey]

HDKLIZDXVUCLHQ-BQYQJAHWSA-N
[SMILES]

[H]\C(CCCCC)=C(\[H])C(C)=O
[LogP]

2.689 (est)
Safety DataBack Directory
[WGK Germany ]

3
[Storage Class]

10 - Combustible liquids
Hazard InformationBack Directory
[Uses]

trans-3-Nonen-2-one is a useful reagent in the synthesis of olivetolic acid (O533005).
[Definition]

ChEBI: (3E)-3-nonen-2-one is an enone that is (E)-3-nonene in which the two methylene hydrogens at position 2 have been replaced by an oxo group. It has a role as an EC 2.5.1.18 (glutathione transferase) inhibitor and a fumigant.
Spectrum DetailBack Directory
[Spectrum Detail]

3-NONEN-2-ONE(18402-83-0)MS
3-NONEN-2-ONE(18402-83-0)1HNMR
3-NONEN-2-ONE(18402-83-0)13CNMR
3-NONEN-2-ONE(18402-83-0)IR1
3-NONEN-2-ONE(18402-83-0)Raman
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