Chemical Properties of 4-methyl-2-thiaadamantane

4-methyl-2-thiaadamantane

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InChI
InChI=1S/C10H16S/c1-6-8-2-7-3-9(5-8)11-10(6)4-7/h6-10H,2-5H2,1H3
InChI Key
ZBBUECPKKSCLQX-UHFFFAOYSA-N
Formula
C10H16S
SMILES
CC1C2CC3CC(C2)SC1C3
Molecular Weight1
168.30
Sources

Physical Properties

Property Value Unit Source
Δf 227.91 kJ/mol Joback Calculated Property
Δfgas -32.91 kJ/mol Joback Calculated Property
Δfus 19.76 kJ/mol Joback Calculated Property
Δvap 42.96 kJ/mol Joback Calculated Property
logPoct/wat 2.93 Crippen Calculated Property
Pc 2969.80 kPa Joback Calculated Property
Tboil 491.18 K Joback Calculated Property
Tc 718.92 K Joback Calculated Property
Tfus 327.73 K Joback Calculated Property
Vc 0.50 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 326.26 J/mol×K 491.18 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CH3 1
>CH- (ring) 5
-S- (ring) 1
-CH2- (ring) 4

Similar Compounds

4,8-dimethyl-2-thiaadamantane. 4,8-diethyl-2-thiaadamantane. 4,8-dibutyl-2-thiaadamantane. 4,8-dipropyl-2-thiaadamantane. 2H-1-Benzothiopyran, octahydro-2-methyl-. 2-Thiatricyclo[3.3.1.1(3,7)]decane. 4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane. cis,cis-2-Methyl-1-thiadecalin. cis,trans-2-Methyl-1-thiadecalin. trans, cis-2-Methyl-1-thiadecalin. Cyclohexane, cis-1-methyl-4-(1-methylethyl), 2,3-bis-(methylthio). Cyclohexane, trans-1-methyl-4-(1-methylethyl), 2,3-bis-(methylthio). 2-Norbornanethiol, acetate. Cyclohexane, 1-methyl-4-(1-methylethyl)-1,2-bis-(methylthio). Trans-2,3-dimethylthiane.

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