Chemical Properties of Bicyclo[4.1.0]heptane, 3,7,7-trimethyl-3,4-bis-(methylthio)

Bicyclo[4.1.0]heptane, 3,7,7-trimethyl-3,4-bis-(methylthio)

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InChI
InChI=1S/C12H22S2/c1-11(2)8-6-10(13-4)12(3,14-5)7-9(8)11/h8-10H,6-7H2,1-5H3/t8?,9?,10-,12+/m0/s1
InChI Key
GHHXTHWFXOUDSH-ILDFIYDHSA-N
Formula
C12H22S2
SMILES
CSC1CC2C(CC1(C)SC)C2(C)C
Molecular Weight1
230.43
Sources

Physical Properties

Property Value Unit Source
Δf 191.69 kJ/mol Joback Calculated Property
Δfgas -98.37 kJ/mol Joback Calculated Property
Δfus 19.88 kJ/mol Joback Calculated Property
Δvap 52.71 kJ/mol Joback Calculated Property
logPoct/wat 3.91 Crippen Calculated Property
Pc 2356.49 kPa Joback Calculated Property
Tboil 615.74 K Joback Calculated Property
Tc 864.38 K Joback Calculated Property
Tfus 361.24 K Joback Calculated Property
Vc 0.71 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 509.67 J/mol×K 615.74 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>C< (ring) 2
-S- 2
-CH3 5
>CH- (ring) 3
-CH2- (ring) 2

Similar Compounds

Cyclohexane, 1-methyl-4-(1-methylethyl)-1,2-bis-(methylthio). Bicyclo[3.1.1]heptane, 2,6,6-trimethyl, 2,3-bis-(methylthio). Bicyclo[3.3.1]heptane, 6,6-dimethyl-2,7-bis-(methylthio). Cyclohexane, trans-1-methyl-4-(1-methylethyl), 2,3-bis-(methylthio). Cyclohexane, cis-1-methyl-4-(1-methylethyl), 2,3-bis-(methylthio). Hexadecane, 2-methyl-1,2-bis(methylthio). cis,trans-2-Methyl-1-thiadecalin. cis,cis-2-Methyl-1-thiadecalin. trans, cis-2-Methyl-1-thiadecalin. 4,8-dibutyl-2-thiaadamantane. 4,8-diethyl-2-thiaadamantane. 4,8-dipropyl-2-thiaadamantane. 4-methyl-2-thiaadamantane. 4,8-dimethyl-2-thiaadamantane. 2-Heptanone, 6-methyl-5,6-bis-(methylthio).

Find more compounds similar to Bicyclo[4.1.0]heptane, 3,7,7-trimethyl-3,4-bis-(methylthio).

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