ChemicalBook--->CAS DataBase List--->432-25-7

432-25-7

432-25-7 Structure

432-25-7 Structure
IdentificationBack Directory
[Name]

BETA-CYCLOCITRAL
[CAS]

432-25-7
[Synonyms]

FEMA 3639
B-CYCLOCITRAL
β-cyclocitral
á-cyclocitral
BETA-CYCLOCITRAL
CYCLOCITRAL, BETA-
~-Cyclocitral,70+%
SS-CYCLOCITRAL: 70%
β-Cyclocitral, 90+%
^b-Cyclocitral, 90+%
SALOR-INT L170038-1EA
BETA-CYCLOCITRAL 90+%
beta-Cyclocitral, 70+%
^b-Cyclocitral, tech. 80%
Pentadeuterio--cyclocitral
Pentadeuterio-b-cyclocitral
beta-Cyclocitral (tech grade)
-Cyclocitral, Technical Grade
1-Formyl-2,6,6-trimethyl-1-cyclohexene
2,6,6-trimethylcyclohexene-1-carbaldehyde
2,6,6-triMethylcyclohex-1-enecarbaldehyde
2,6,6-Trimethyl-1-cyclohexenecarboxaldehyd
2,6,6-Trimethyl-1-cyclohexenecarboxaldehyde
2,6,6-Trimethyl-1-cyclohexene-1-carbaldehyde
2,6,6-trimethyl-1-cyclohexene-1-carboxaldehyd
2,6,6-TRIMETHYL-1-CYCLOHEXANE-1-CARBOXALDEHYDE
2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-CARBOXALDEHYDE
2,6,6-TRIMETHYL-1&2-CYCLOHEXEN-1-CARBOXALDEHYDE
1-Cyclohexene-1-carboxaldehyde, 2,6,6-trimethyl-
2,2-Dimethyl-6-methylenecyclohexane-1-carbaldehyde
β-Cyclocitral,2,6,6-Trimethyl-1-cyclohexene-1-carboxaldehyde
[EINECS(EC#)]

207-081-3
[Molecular Formula]

C10H16O
[MDL Number]

MFCD00079078
[MOL File]

432-25-7.mol
[Molecular Weight]

152.23
Chemical PropertiesBack Directory
[Appearance]

Colourless Oil
[Melting point ]

62-63 C
[Boiling point ]

62-63 °C3 mm Hg(lit.)
[density ]

0.943 g/mL at 25 °C(lit.)
[FEMA ]

3639 | 2,6,6-TRIMETHYL-1&2-CYCLOHEXEN-1-CARBOXALDEHYDE
[refractive index ]

n20/D 1.497(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Slightly), Dichloromethane, Ethyl Acetate (Slightly), Methanol (Slightly)
[form ]

Oil
[color ]

Colourless to Dark Yellow
[Odor]

at 10.00 % in dipropylene glycol. tropical saffron herbal clean rose oxide sweet tobacco damascone fruity
[Odor Type]

tropical
[Water Solubility ]

Soluble in chloroform, dichloromethane, ethyl acetate and methanol. Insoluble in water.
[Sensitive ]

Air Sensitive
[JECFA Number]

979
[Stability:]

Light Sensitive
[Major Application]

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

PERFUMING
[InChI]

1S/C10H16O/c1-8-5-4-6-10(2,3)9(8)7-11/h7H,4-6H2,1-3H3
[InChIKey]

MOQGCGNUWBPGTQ-UHFFFAOYSA-N
[SMILES]

[H]C(=O)C1=C(C)CCCC1(C)C
[LogP]

3.26
[EPA Substance Registry System]

1-Cyclohexene-1-carboxaldehyde, 2,6,6-trimethyl- (432-25-7)
Hazard InformationBack Directory
[Chemical Properties]

Colourless Oil
[Definition]

ChEBI: A monoterpenoid formally derived from citral by cyclisation. It is a volatile compound produced by a cyanobacteria.
[Occurrence]

Reported found in tea, apricot, melon, tomato, tomato paste, ginger, rum, Japanese plum, plumcot, mango, apple brandy, calamus, buckwheat, Bourbon vanilla, cape gooseberry and maté.
[Uses]

beta-Cyclocitral is used as flavoring agent, nutrient, stabilizers, surfactants and emulsifiers.
[Production Methods]

BETA-CYCLOCITRAL can be produced by condensation of Citral with Aniline, followed by hydrolysis and separation of the alpha and beta isomers by fractionated distillation.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 69, p. 2072, 1947 DOI: 10.1021/ja01200a519
Synthesis, p. 781, 1975
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P280-P301+P312+P330-P302+P352+P312-P304+P340+P312-P305+P351+P338
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

20/21/22-36/37/38
[Safety Statements ]

26-36-37/39
[RIDADR ]

1760
[WGK Germany ]

3
[TSCA ]

Yes
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29122990
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Methanol-->Diethyl ether-->Sulfuric acid-->Dichloromethane-->Sodium sulfate-->Magnesium sulfate-->Potassium hydroxide-->Sodium chloride-->Aniline-->Citral-->2,6,6-Trimethylcyclohex-2-ene-1-ylcarbonitrile-->2,6,6-trimethylcyclohexene-1-methanol
[Preparation Products]

Cyclohexene, 2-ethenyl-1,3,3-trimethyl-
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