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Basic Information
CAS No.: 115-71-9
Name: 5-(2,3-dimethyltricyclo[2.2.1.02,6]hept-3-yl)-2-methylpent-2-en-1-ol, stereoisomer
Molecular Structure:
Molecular Structure of 115-71-9 (5-(2,3-dimethyltricyclo[2.2.1.02,6]hept-3-yl)-2-methylpent-2-en-1-ol, stereoisomer)
Formula: C15H24 O
Molecular Weight: 220.355
Synonyms: 2-Penten-1-ol,5-(2,3-dimethyltricyclo[2.2.1.02,6]hept-3-yl)-2-methyl-, [R(Z)]- (8CI);2-Penten-1-ol, 5-(2,3-dimethyltricyclo[2.2.1.02,6]hept-3-yl)-2-methyl-,stereoisomer;a-Santalol(6CI,7CI);Tricyclo[2.2.1.02,6]heptane, 2-penten-1-ol deriv.;(+)-(Z)-a-Santalol;(+)-a-Santalol;(Z)-a-Santalol;Sandal;Santalol a;cis-a-Santalol;d-a-Santalol;29887-36-3;
EINECS: 204-102-8
Density: 1.03g/cm3
Boiling Point: 299.5°Cat760mmHg
Flash Point: 138.6°C
Safety: Moderately toxic by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
PSA: 20.23000
LogP: 3.38740
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Chemistry

IUPAC Name: cis-α-Santalol
Synonyms of cis-α-Santalol (CAS NO.115-71-9) : (2Z)-5-[(1R,3S,4S)-2,3-Dimethyltricyclo[2.2.1.0~2,6~]hept-3-yl]-2-methylpent-2-en-1-ol ; .alpha.-Santalol ; 2-Penten-1-ol, 5-[(1R,3S,4S)-2,3-dimethyltricyclo[2.2.1.0~2,6~]hept-3-yl]-2-methyl-, (2Z)- ; 5-(2,3-Dimethyltricyclo[2.2.1.02,6]hept-3-yl)-2-methyl-2-penten-1-ol ; alpha-Santalol ; a-Santalol
InChI:InChI=1/C15H24O/c1-10(9-16)5-4-6-14(2)11-7-12-13(8-11)15(12,14)3/h5,11-13,16H,4,6-9H2,1-3H3/b10-5-/t11-,12+,13?,14-,15?/m0/s1
CAS NO:115-71-9
Molecular Formula:C15H24O                                                         
Molecular Weight :220.3505            
Molecular Structure :
EINECS: 204-102-8
Index of Refraction: 1.537  
Surface Tension: 42.8 dyne/cm 
Density: 1.03 g/cm3 
Flash Point: 138.6 °C 
Enthalpy of Vaporization: 62.58 kJ/mol 
Boiling Point: 299.5 °C at 760 mmHg 
Vapour Pressure: 0.000118 mmHg at 25°C  
Appearance:Yellow sticky-shaped micro-volatile oils, with a strong durable wood aroma characteristic.
Solubility:Soluble in ethanol, the majority of non-volatile oil, propylene glycol and mineral oil, and sometimes may appear cloudy, do not dissolve in glycerin and water.

Uses

China GB 2760-96 provides cis-α-Santalol (CAS NO.115-71-9) for the use of food spices.

Production

Raw materials: Sandenol-->SANTALUM ALBUM (SANDALWOOD)

 Cis-α-Santalol (CAS NO.115-71-9) can be derived by drying and steam distillation of roots and xylem of Indian sandalwood (Santalum album), the yield of about 4%. Mainly in India, China also has small introduction.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 991, 1974.
rat LD50 oral 3800mg/kg (3800mg/kg)   Food and Cosmetics Toxicology. Vol. 12, Pg. 991, 1974.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Moderately toxic by ingestion and skin contact. A skin irritant. When cis-α-Santalol (CAS NO.115-71-9) is heated to decomposition ,it emits acrid smoke and irritating vapors.