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126-90-9

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126-90-9 Structure

126-90-9 Structure
IdentificationBack Directory
[Name]

(S)-3,7-dimethyl-1,6-octadien-3-ol
[CAS]

126-90-9
[Synonyms]

(S)-linalool
dextro-linalool
NATURAL Linalool
LINALOOLSYNTHETIC
(s)-3,7-dimethyl-1,6
Dextro-linalool(natural)
7-dimethyl-6-octadien-3-o (s)-3
(S)-3,7-dimethyl-1,6-octadien-3-ol
6-Octadien-3-ol, 3,7-dimethyl-, (S)-1
1,6-Octadien-3-ol, 3,7-dimethyl-, (3S)-
[EINECS(EC#)]

204-810-7
[Molecular Formula]

C10H18O
[MDL Number]

MFCD09025547
[MOL File]

126-90-9.mol
[Molecular Weight]

154.25
Chemical PropertiesBack Directory
[Melting point ]

38-39 °C
[Boiling point ]

87-88 °C
[density ]

0.8700 g/cm3
[FEMA ]

2635 | LINALOOL
[storage temp. ]

2-8°C, stored under nitrogen
[pka]

14.51±0.29(Predicted)
[Appearance]

Colorless to light yellow Liquid
[Odor]

at 100.00 %. sweet floral petitgrain lavender
[Odor Type]

floral
[JECFA Number]

356
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3/t10-/m1/s1
[InChIKey]

CDOSHBSSFJOMGT-SNVBAGLBSA-N
[SMILES]

C=C[C@@](C)(O)CC/C=C(\C)/C
[LogP]

2.795 (est)
[EPA Substance Registry System]

1,6-Octadien-3-ol, 3,7-dimethyl-, (3S)- (126-90-9)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H317
[Precautionary statements ]

P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
[TSCA ]

TSCA listed
Hazard InformationBack Directory
[Definition]

ChEBI: The (S)-enantiomer of linalool.
Spectrum DetailBack Directory
[Spectrum Detail]

(S)-3,7-dimethyl-1,6-octadien-3-ol(126-90-9)1HNMR
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