| Identification | Back Directory | [Name]
PINANYL MERCAPTAN | [CAS]
23832-18-0 | [Synonyms]
FEMA 3503
PINANETHIOL
mango thiol
2-pinanethiol
2-mercapto-pinan
2-mercaptopinane
PINANYL MERCAPTAN
2(3)-Mercaptopinane
2,3OR10-MERCAPTOPINANE
2,(3),(10)-MERCAPTOPINANE
2, 3, AND 10-MERCAPTOPINANE
2- 3- AND 10-MERCAPTOPINANE 95% &
2,6,6-Trimethylbicyclo[3.1.1]heptan-2-thiol
2,6,6-trimethylbicyclo[3.1.1]heptane-2-thiol
2,6,6-trimethyl-bicyclo(3.1.1)heptane-2-thio
2,6,6-trimethyl-bicyclo[3.1.1]heptane-2-thio
Bicyclo3.1.1heptane-2-thiol, 2,6,6-trimethyl-
2-,3-,10-Mercaptopinane mixture of isomers, FG
2,6,6 TRIMETHYL-BICYCLO[3.1.1]HEPTANE-(2,3 AND 10)-THIOL | [EINECS(EC#)]
245-900-6 | [Molecular Formula]
C10H18S | [MDL Number]
MFCD00213571 | [MOL File]
23832-18-0.mol | [Molecular Weight]
170.31 |
| Chemical Properties | Back Directory | [Boiling point ]
142 °C20 mm Hg(lit.) | [density ]
0.98 g/mL at 25 °C(lit.) | [FEMA ]
3503 | 2,3 OR 10-MERCAPTOPINANE | [refractive index ]
n20/D 1.5(lit.) | [Fp ]
208 °F | [pka]
11.24±0.40(Predicted) | [Odor]
at 0.10 % in dipropylene glycol. sulfury green tropical terpene woody berry seedy buchu | [biological source]
synthetic | [Odor Type]
sulfurous | [JECFA Number]
520 | [Major Application]
flavors and fragrances | [InChI]
InChI=1S/C10H18S/c1-9(2)7-4-5-10(3,11)8(9)6-7/h7-8,11H,4-6H2,1-3H3 | [InChIKey]
ZPUCQOXKFCVYGL-UHFFFAOYSA-N | [SMILES]
C12CC(C1(C)C)CCC2(C)S | [LogP]
4.20 | [EPA Substance Registry System]
Bicyclo[3.1.1]heptane-2-thiol, 2,6,6-trimethyl- (23832-18-0) |
| Safety Data | Back Directory | [RIDADR ]
UN 3334 | [WGK Germany ]
3 | [RTECS ]
TK4575000 | [TSCA ]
TSCA listed | [Storage Class]
10 - Combustible liquids |
| Hazard Information | Back Directory | [Chemical Properties]
2-, 3- or 10-Mercaptopinane has a sulfurous, tropical fruit, mercaptan odor and a grapefruit taste. Contains approxi mately 54% 10-isomer, 31% 2-isomer and 10% 3-isomer. | [Uses]
flavors and fragrances | [Taste threshold values]
Taste characteristics: sulfurous, metallic, tropical, woody, fresh, green and cooling. |
|
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