Isothiocineole

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Names

[ CAS No. ]:
5718-75-2

[ Name ]:
Isothiocineole

[Synonym ]:
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

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

MSDS

Click to get detail MSDS

Safety Information

[ Hazard Codes ]:
N

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • limonene

DownStream

  • p-Menthane, trans-
  • p-Menthane, cis-
  • (+)-Limonene
  • (+)-P-MENTH-1-ENE

Related Compounds

  • (1S,4S,5S)-isothiocineole
  • (2R)-2-(4-chlorophenyl)-4-(2-phenylethyl)morpholine
  • 3-(tetrahydro-2H-pyran-4-yl)alanine ethyl ester
  • (2S)-2-(4-Chlorophenyl)-4-[(1S)-1-phenylethyl]morpholine
  • 1-[4-(Benzyloxy)phenyl]-2-{[(1R)-1-phenylethyl]amino}ethan-1-one
  • 3-[(2-Methylbutan-2-yl)oxy]azetidine
  • (2R)-2-(4-bromophenyl)-4-[(4-methoxyphenyl)methyl]morpholine
  • 2-[2-(Azetidin-3-yloxy)ethyl]pyridine
  • 4-(2-Benzylhydrazineyl)-6-phenylpyrimidin-2-amine
  • ethyl (2R)-2-(4-nitrophenyl)morpholine-4-carboxylate
  • (2R)-4-[(4-methoxyphenyl)methyl]-2-(4-nitrophenyl)morpholine
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