Isothiocineole

Modify Date: 2025-08-26 14:20:54

Isothiocineole Structure
Isothiocineole structure
Common Name Isothiocineole
CAS Number 5718-75-2 Molecular Weight 170.315
Density 0.9±0.1 g/cm3 Boiling Point 222.7±9.0 °C at 760 mmHg
Molecular Formula C10H18S Melting Point N/A
MSDS N/A Flash Point 79.0±15.4 °C

 Names

Name (1R,4R,5R)-4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.9±0.1 g/cm3
Boiling Point 222.7±9.0 °C at 760 mmHg
Molecular Formula C10H18S
Molecular Weight 170.315
Flash Point 79.0±15.4 °C
Exact Mass 170.112915
PSA 25.30000
LogP 3.84
Vapour Pressure 0.1±0.4 mmHg at 25°C
Index of Refraction 1.493
Storage condition 2~8°C

 Safety Information

Hazard Codes N

 Synthetic Route

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Detail
Literature: Journal of Organic Chemistry USSR (English Translation), , vol. 19, p. 283 - 291 Zhurnal Organicheskoi Khimii, , vol. 19, # 2 p. 321 - 332

~%

Detail
Literature: Journal of Organic Chemistry USSR (English Translation), , vol. 19, p. 283 - 291 Zhurnal Organicheskoi Khimii, , vol. 19, # 2 p. 321 - 332

~%

Detail
Literature: Journal of Organic Chemistry USSR (English Translation), , vol. 19, p. 283 - 291 Zhurnal Organicheskoi Khimii, , vol. 19, # 2 p. 321 - 332

 Synonyms

6-Thiabicyclo(3.2.1)octane, 4,7,7-trimethyl-
2,8-Epithio-p-menthane
4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane
UNII:EMJ1A8616F
6-Thiabicyclo[3.2.1]octane, 4,7,7-trimethyl-
T56 A CSTJ D1 D1 H1
4,7,7-Trimethyl-6-thiabicyclo(3.2.1)octane
exo-(-)-4,7,7-Trimethyl-6-thiabicyclo(3.2.1)octane
thiocineole
Isothiocineole
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