ChemicalBook--->CAS DataBase List--->11031-45-1

11031-45-1

11031-45-1 Structure

11031-45-1 Structure
IdentificationBack Directory
[Name]

SANTALOL
[CAS]

11031-45-1
[Synonyms]

SANTALOL
FEMA 3006
β-Santalol
D-ALPHA-SANTALOL
A AND B-SANTALOL
CIS-ALPHA-SANTALOL
2-Methyl-5-((1S,2S,4R)
SANTALOL (ALPHA AND BETA )
Santalol, α- and β-isomers
SANTALOL ALPHA- AND BETA- FCC
Santalol, alpha- and beta-isomers
-2-methyl-3-methylenebicyclo[2.2.1]heptan-2-yl)
2-PENTEN-1-OL, 5-(2,3-DIMETHYL TRICYCLO [2.2.1.0(2,6)] HEPT-3-YL)-2-METHYL
2-Methyl-5-((1S,2S,4R)-2-Methyl-3-Methylenebicyclo[2.2.1]heptan-2-yl)pent-2-en-1-ol
[EINECS(EC#)]

234-262-4
[Molecular Formula]

C15H24O
[MDL Number]

MFCD00046301
[MOL File]

11031-45-1.mol
[Molecular Weight]

220.35
Chemical PropertiesBack Directory
[density ]

0.968 g/mL at 25 °C(lit.)
[FEMA ]

3006 | SANTALOL (ALPHA AND BETA )
[refractive index ]

n20/D 1.507(lit.)
[storage temp. ]

-20°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Oil
[color ]

Colourless
[Odor]

at 100.00 %. deep sweet sandalwood woody
[Odor Type]

woody
[JECFA Number]

984
[Boiling point ]

101-103°C/0.1 mmHg(lit.)
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

InChI=1S/C15H24O/c1-11(10-16)5-4-8-15(3)12(2)13-6-7-14(15)9-13/h5,13-14,16H,2,4,6-10H2,1,3H3/b11-5+
[InChIKey]

OJYKYCDSGQGTRJ-VZUCSPMQSA-N
[SMILES]

C1(C)(CC/C=C(\C)/CO)C(=C)C2CCC1C2
[LogP]

4.65
[Uses]

Santalol is a flavoring agent that is a colorless or pale yellow liquid, with odor resembling sandalwood. it is soluble in alcohol, fixed oils, mineral oil, and propylene glycol; and insoluble in water and glyc- erin. it is obtained from a sandalwood oil source.
[EPA Substance Registry System]

Santalol (11031-45-1)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[WGK Germany ]

WGK 2
[TSCA ]

TSCA listed
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Xylene-->FEMA 3005
Hazard InformationBack Directory
[Chemical Properties]

Santalol (α- and β-) has a sweet, sandalwood odor.
[Occurrence]

The stereochemistry of santalols has been discussed by Brieger (Burdock, 1995); santalols are found among the constituents of various sandalwood species (Santalum album L., S. spicatum, S. autrocaledonicum); the α- and β-isomers are present in varying ratios, with the α-isomer usually more abundant.
[Synthesis]

The commercial product is generally a mixture of α- and β-santalol obtained by fractional distillation of sandalwood oil; noncommercial syntheses are known.
[in vivo]

α-Santalol (i.p. 12.5 mg/kg, 25 mg/kg, 50 mg/kg) prolongs the sleeping time more than β-Santalol when they were each administered intragastrically in male ddY mice[3].
α-Santalol (i.p. 12.5 mg/kg, 25 mg/kg, 50 mg/kg) reduces rectal temperature in a dose-related manner following i.p. administration and the magnitude of activity is greater than that of β-Santalol in male ddY mice [3].
α-Santalol and β-Santalol (p.o., 50 mg/kg, 100 mg/kg, 200 mg/kg) shows significant antinociceptive activities in male ddY mice[3].
α-Santalol and β-Santalol (i.p., 50 mg/kg) decreases spontaneous activity and simultaneously shows motor incoordination, such as catalepsy, but does not cause ptosis, hypnosis and muscle relaxation in male ddY mice [3].
α-Santalol (i.p., 25 mg/kg, 50 mg/kg) causes a greater reduction in methamphetamine-induced (at 2 mg/kg) motilities than β-Santalol in male ddY mice [3].
α-Santalol and β-Santalol (i.p., 25 mg/kg, 50 mg/kg) significantly decreases apomorphine-induced (2 mg/kg) movements in male ddY mice [3].
α-Santalol (i.p., 50 mg/kg) significantly increases the levels of HVA (homovanillic acid), and 5-HIAA (5-hydroxyindoleacetic acid) in the brain of treated mice[3].
β-Santalol (i.p., 50 mg/kg) increases the levels of DOPAC (3,4-dihydroxyphenylacetic acid), and 5-HT(serotonin creatinine sulfate) besides HVA and 5-HIAA in male ddY mice[3].

Spectrum DetailBack Directory
[Spectrum Detail]

SANTALOL(11031-45-1)1HNMR
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