ChemicalBook--->CAS DataBase List--->143615-81-0

143615-81-0

143615-81-0 Structure

143615-81-0 Structure
IdentificationBack Directory
[Name]

(S)-(+)-CITRONELLYL BROMIDE
[CAS]

143615-81-0
[Synonyms]

(S)-(+)-CITRONELLYL BROMIDE
8-BROMO-2,6-DIMETHYL-2-OCTENE
(S)-(+)-Citronellyl broMide 95%
(S)-2,6-Dimethyl-8-bromo-2-octene
(6S)-8-bromo-2,6-dimethyloct-2-ene
(6S)-2,6-Dimethyl-8-bromo-2-octene
[S,(+)]-8-Bromo-2,6-dimethyl-2-octene
2-Octene, 8-bromo-2,6-dimethyl-, (6S)-
[Molecular Formula]

C10H19Br
[MDL Number]

MFCD00134459
[MOL File]

143615-81-0.mol
[Molecular Weight]

219.16
Chemical PropertiesBack Directory
[Boiling point ]

111 °C/12 mmHg (lit.)
[density ]

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

n20/D 1.474(lit.)
[Fp ]

203 °F
[form ]

liquid
[Optical Rotation]

[α]20/D +6.8°, neat
[InChI]

1S/C10H19Br/c1-9(2)5-4-6-10(3)7-8-11/h5,10H,4,6-8H2,1-3H3/t10-/m0/s1
[InChIKey]

QPKCDMXLSDFCQD-JTQLQIEISA-N
[SMILES]

C[C@H](CCBr)CC\C=C(\C)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-37/39
[WGK Germany ]

3
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

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

(S)-(+)-Citronellyl bromide can be used as a reactant in the Negishi cross-coupling reaction. It is also used in the synthesis of spiroacetal parts of spirofungin A and B by reacting with epoxy alcohol via alkyne–lactone coupling reaction and diastereomeric separation.
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-(+)-CITRONELLYL BROMIDE(143615-81-0)1HNMR
(S)-(+)-CITRONELLYL BROMIDE(143615-81-0)Raman
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