ChemicalBook--->CAS DataBase List--->90-42-6

90-42-6

90-42-6 Structure

90-42-6 Structure
IdentificationMore
[Name]

2-CYCLOHEXYLCYCLOHEXANONE
[CAS]

90-42-6
[Synonyms]

2-CYCLOHEXYLCYCLOHEXANONE
2-CYCLOHEXYL CYLCOHEXANONE
2-CYCLOHEXYLCYLOHEXANONE
CYCLOHEXYLCYCLOHEXANONE
CYCLOHEXYLCYCLOHEXANONE, 2-
TIMTEC-BB SBB007775
(1,1’-bicyclohexyl)-2-one
[1,1’-Bicyclohexyl]-2-one
[1,1'-Bicyclohexyl]-2-one
2-cyclohexyl-cyclohexanon
Cyclohexanone, 2-cyclohexyl-
cyclohexanone,2-cyclohexyl-
Lavamenthe
1,1'-Bicyclohexan-2-one
[EINECS(EC#)]

201-991-4
[Molecular Formula]

C12H20O
[MDL Number]

MFCD00013795
[Molecular Weight]

180.29
[MOL File]

90-42-6.mol
Chemical PropertiesBack Directory
[Melting point ]

-32°C
[Boiling point ]

269 °C
[density ]

0,97 g/cm3
[refractive index ]

1.4880-1.4900
[Fp ]

121°C
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

clear liquid
[color ]

A colourless liquid with a comparatively sweet odour
[Odor]

at 100.00 %. cyclamen sweet herbal cumin mint woody orris ozone
[Odor Type]

herbal
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C12H20O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h10-11H,1-9H2
[InChIKey]

UOBQDYFTAJKQAL-UHFFFAOYSA-N
[SMILES]

O=C1CCCCC1C2CCCCC2
[LogP]

3.810
[CAS DataBase Reference]

90-42-6(CAS DataBase Reference)
[EPA Substance Registry System]

[1,1'-Bicyclohexyl]-2-one (90-42-6)
Safety DataBack Directory
[Safety Statements ]

S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

WGK 2
[RTECS ]

DT7400000
[TSCA ]

TSCA listed
[HS Code ]

2914290090
[Storage Class]

10 - Combustible liquids
[Hazardous Substances Data]

90-42-6(Hazardous Substances Data)
[Toxicity]

The acute oral LD50 was reported as > 5 g/kg in the rat (Denine, 1973). The acute dermal LD50 was reported as > 5 g/kg in the rabbit (Denine, 1973).
Hazard InformationBack Directory
[Chemical Properties]

Minty, somewhat dry taste. Slightly bitter in higher concentrations but bitterness is less pronounced in compositions with other flavoring materials or at lower concentration.
[Occurrence]

Apparently has not been reported to occur in nature.
[Preparation]

By self-condensation of cyclohexanone followed by reduction.
Spectrum DetailBack Directory
[Spectrum Detail]

2-CYCLOHEXYLCYCLOHEXANONE(90-42-6)MS
2-CYCLOHEXYLCYCLOHEXANONE(90-42-6)1HNMR
2-CYCLOHEXYLCYCLOHEXANONE(90-42-6)13CNMR
2-CYCLOHEXYLCYCLOHEXANONE(90-42-6)IR1
2-CYCLOHEXYLCYCLOHEXANONE(90-42-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-Cyclohexylcyclohexanone, 95%(90-42-6)
[TCI AMERICA]

2-Cyclohexylcyclohexanone,>95.0%(GC)(90-42-6)
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