ChemicalBook--->CAS DataBase List--->18829-56-6

18829-56-6

18829-56-6 Structure

18829-56-6 Structure
IdentificationMore
[Name]

TRANS-2-NONENAL
[CAS]

18829-56-6
[Synonyms]

2-NONEN-1-AL
ALPHA-NONENYL ALDEHYDE
BETA-HEXYLACROLEIN
FEMA 3213
NON-2-ENAL
T2 NONENAL
TIMTEC-BB SBB006609
TRANS-2-NONEN-1-AL
TRANS-2-NONENAL
(2E)-2-Nonenal
(2E)nonenal
(E)-2-nonen-1-al
(E)-2-Nonenal
(E)-Non-2-enal
Non-2-(E)-enal
trans-Non-2-enal
TRANS-2-NONENAL 93+%
FCC
(E)-2-nonenal,trans-2-nonenal
2-Nonenal, (2E)-
[EINECS(EC#)]

242-609-6
[Molecular Formula]

C9H16O
[MDL Number]

MFCD00007012
[Molecular Weight]

140.22
[MOL File]

18829-56-6.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLOURLESS TO PALE YELLOW LIQUID
[Melting point ]

-28°C (estimate)
[Boiling point ]

88-90 °C12 mm Hg(lit.)
[density ]

0.846 g/mL at 25 °C(lit.)
[vapor density ]

>1 (vs air)
[FEMA ]

3213 | 2-NONENAL
[refractive index ]

n20/D 1.453(lit.)
[Fp ]

184 °F
[storage temp. ]

Refrigerator (+4°C)
[solubility ]

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

Liquid
[color ]

Clear colorless to pale yellow
[Odor]

at 1.00 % in dipropylene glycol. fatty green cucumber aldehydic citrus
[biological source]

synthetic
[Odor Type]

fatty
[Water Solubility ]

Soluble in Alcohol , and oils. Insoluble in water.
[Sensitive ]

Air Sensitive
[JECFA Number]

1362
[Merck ]

14,6676
[Major Application]

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

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

BSAIUMLZVGUGKX-BQYQJAHWSA-N
[SMILES]

[H]C(=O)C(\[H])=C(/[H])CCCCCC
[LogP]

3.17
[CAS DataBase Reference]

18829-56-6(CAS DataBase Reference)
[EPA Substance Registry System]

2-Nonenal, (2E)- (18829-56-6)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

NA 1993 / PGIII
[WGK Germany ]

3
[RTECS ]

RA8509050
[TSCA ]

Yes
[HazardClass ]

3
[PackingGroup ]

II
[HS Code ]

29121900
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

CLEAR COLOURLESS TO PALE YELLOW LIQUID
[Uses]

trans-2-Nonenal is an unsaturated aldehyde that is a product of fatty acid peroxidation (and also has a grassy, cucumber smell). trans-2-Nonenal is naturally found in mushrooms, coffee and is also a constituent of carrot root. It also exhibits insecticidal effects.
[Definition]

ChEBI: (E)-non-2-enal is a monounsaturated fatty aldehyde that is (2E)-non-2-ene which is carrying an oxo group at position 1. It has a role as a plant metabolite. It is a monounsaturated fatty aldehyde, an enal and a medium-chain fatty aldehyde.
[Synthesis Reference(s)]

Tetrahedron Letters, 24, p. 4829, 1983 DOI: 10.1016/S0040-4039(00)94018-8
[General Description]

trans-2-Nonenal (T2N) is a volatile unsaturated aldehyde with an unpleasant greasy odor, present in low concentrations in barley, malt, and certain vegetables. It is utilized as an insect repellent, insecticide, and flavor compound. T2N is one of the basic components contributing to the off-flavor and odor in stored beer.
[Synthesis]

(1), the synthesis of α-phenylthio-nonenal
Take n-nonynyl (0.12 g, 1 mmol), phenylthiophenol (2a) (0.33 g, 3 mmol) was dissolved in chloroform, the reaction was carried out at 20 ℃; the reaction was tracked by TLC until it was completely finished;

Spectrum DetailBack Directory
[Spectrum Detail]

TRANS-2-NONENAL(18829-56-6)MS
TRANS-2-NONENAL(18829-56-6)1HNMR
TRANS-2-NONENAL(18829-56-6)13CNMR
TRANS-2-NONENAL(18829-56-6)IR1
TRANS-2-NONENAL(18829-56-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

trans-2-Nonenal, 95%(18829-56-6)
[Alfa Aesar]

trans-2-Nonenal, 97%(18829-56-6)
[Sigma Aldrich]

18829-56-6(sigmaaldrich)
[TCI AMERICA]

trans-2-Nonenal,>95.0%(GC)(18829-56-6)
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