ChemicalBook--->CAS DataBase List--->1335-66-6

1335-66-6

1335-66-6 Structure

1335-66-6 Structure
IdentificationBack Directory
[Name]

ISOCYCLOCITRAL
[CAS]

1335-66-6
[Synonyms]

xene
1335-66-6
ISOCYCLOCITRAL
Einecs 215-638-7
xene-1-carboxaldehyde
ISOCYCLOCITRAL USP/EP/BP
Isocyclocitral(mixture of isomers)
3,5,6-triMethylcyclohex-3-enecarbaldehyde
4,5,6-Trimethyl-3-cyclohexene-1-carbaldehyde
3-CYCLOHEXENE-1-CARBOXALDEHYDE, 2,4,6-TRIMETHYL
1-formyl-3,5,6-trimethyl-3-cyclohexeneand1-formyl-2,4,6-trimethyl-3-cyclohe
3-cyclohexene-1-carboxaldehyde,2,4,6-trimethyl-,and3,5,6-trimethyl-3-cyclohe
1-Formyl-3,5,6-trimethyl-3-cyclohexene and 1-formyl-2,4,6-trimethyl-3-cyclohexene
3-Cyclohexene-1-carboxaldehyde, 2,4,6-trimethyl-, and 3,5,6-trimethyl-3-cyclohexene-1-carboxaldehyde
[EINECS(EC#)]

215-638-7
[Molecular Formula]

C20H32O2
[MDL Number]

MFCD00466861
[MOL File]

1335-66-6.mol
[Molecular Weight]

304.47
Chemical PropertiesBack Directory
[Odor]

at 100.00 %. green aldehydic earthy woody herbal leaf
[Odor Type]

green
[LogP]

2.870
[EPA Substance Registry System]

Isocyclocitral (1335-66-6)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H315-H317-H412
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P273-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
[Toxicity]

The acute oral LD50 value in rats was reported to be 4.5 ml/kg (4.16-4.86 ml/kg) (Levenstein, 1973a). The acute dermal LD50 value was reported to be > 5 ml/kg in the rabbit(Levenstein, 1973b).
Hazard InformationBack Directory
[Description]

Reported in several of the NAS food additive surveys, but no technical effect (food functionality) given.
[Occurrence]

Has apparently not been reported to occur in nature
[Definition]

ChEBI: Isocyclocitral is an organooxygen compound.
[Preparation]

By a Diels-Alder-type condensation of 2-methyl-l,3-pentadiene with crotonaldehyde(Bedoukian, 1967).
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