ChemicalBook--->CAS DataBase List--->822-87-7

822-87-7

822-87-7 Structure

822-87-7 Structure
IdentificationMore
[Name]

2-Chlorocyclohexanone
[CAS]

822-87-7
[Synonyms]

2-CHLOROCYCLOHEXANONE
2-chloro-cyclohexanon
alpha-Chlorocyclohexanone
2-Chlorocyclohexanone, stabilized, 95%
2-Chloro-1-cyclohexanone
2-CHLOROCYCLOHEXANONE , STABILIZED WITH CALCIUM CARBONATE/MAGNESIUM OXIDE
2-Chlorocyclohexanone, 97%, stab. with calcium carbonate/magnesium oxide
2-Chlorocyclohexanone (stabilized with HQ)
2-Chlorocyclohexan-1-one
2-Chlorocyclohexanone, 95%, stabilized
[EINECS(EC#)]

212-505-5
[Molecular Formula]

C6H9ClO
[MDL Number]

MFCD00001626
[Molecular Weight]

132.59
[MOL File]

822-87-7.mol
Chemical PropertiesBack Directory
[Appearance]

clear brown liquid
[Melting point ]

23 °C (lit.)
[Boiling point ]

82-83 °C/10 mmHg (lit.)
[density ]

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

n20/D 1.484(lit.)
[Fp ]

180 °F
[storage temp. ]

2-8°C
[form ]

Liquid
[color ]

colorless to very deep brown
[Water Solubility ]

Insoluble in water.
[BRN ]

774100
[InChI]

1S/C6H9ClO/c7-5-3-1-2-4-6(5)8/h5H,1-4H2
[InChIKey]

CCHNWURRBFGQCD-UHFFFAOYSA-N
[SMILES]

ClC1CCCCC1=O
[CAS DataBase Reference]

822-87-7(CAS DataBase Reference)
[NIST Chemistry Reference]

Cyclohexanone, 2-chloro-(822-87-7)
[EPA Substance Registry System]

822-87-7(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H317-H319-H335
[Precautionary statements ]

P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R43:May cause sensitization by skin contact.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
S37/39:Wear suitable gloves and eye/face protection .
S36:Wear suitable protective clothing .
[RIDADR ]

UN 3335
[WGK Germany ]

3
[RTECS ]

GW1225000
[F ]

10-19
[TSCA ]

Yes
[HS Code ]

29147000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Cyclohexanone
[Preparation Products]

2-(3-Methoxyphenyl)cyclohexanone-->trans-1,2-Dichlorocyclohexane-->4,5,6,7-Tetrahydro-benzothiazol-2-ylamine-->1-Cyclohexenyloxytrimethylsilane-->2-Phenylcyclohexanone-->4,5,6,7-tetrahydrobenzo[d]thiazole-->2-Methylcyclohexanone semicarbazone-->6-(3-Methylphenyl)-6-oxohexanoic acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Chlorocyclohexanone(822-87-7).msds
Hazard InformationBack Directory
[Chemical Properties]

clear brown liquid
[Uses]

2-Chlorocyclohexanone, is an intermediate in the synthesis of variety of pharmaceutical compounds. It is also an intermediate in the synthesis of 1-Chloro-2-methylenecyclohexane .
[Synthesis Reference(s)]

Organic Syntheses, Coll. Vol. 3, p. 188, 1955
The Journal of Organic Chemistry, 48, p. 425, 1983 DOI: 10.1021/jo00152a004
Tetrahedron Letters, 20, p. 3653, 1979 DOI: 10.1016/S0040-4039(01)95488-7
Spectrum DetailBack Directory
[Spectrum Detail]

2-Chlorocyclohexanone(822-87-7)MS
2-Chlorocyclohexanone(822-87-7)1HNMR
2-Chlorocyclohexanone(822-87-7)13CNMR
2-Chlorocyclohexanone(822-87-7)IR1
2-Chlorocyclohexanone(822-87-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Chlorocyclohexanone, stabilized, 95%(822-87-7)
[Alfa Aesar]

2-Chlorocyclohexanone, 97%, stab. with calcium carbonate/magnesium oxide(822-87-7)
[Sigma Aldrich]

822-87-7(sigmaaldrich)
[TCI AMERICA]

2-Chlorocyclohexanone  (stabilized with HQ),>95.0%(GC)(822-87-7)
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