Chemical Properties of 2H-1-Benzothiopyran, octahydro-2-methyl- (CAS 42900-28-7)

2H-1-Benzothiopyran, octahydro-2-methyl-

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C10H18S/c1-8-6-7-9-4-2-3-5-10(9)11-8/h8-10H,2-7H2,1H3
InChI Key
UXIZJMFBZMPJGD-UHFFFAOYSA-N
Formula
C10H18S
SMILES
CC1CCC2CCCCC2S1
Molecular Weight1
170.32
CAS
42900-28-7
Sources

Physical Properties

Property Value Unit Source
Δf 138.57 kJ/mol Joback Calculated Property
Δfgas -103.85 kJ/mol Joback Calculated Property
Δfus 14.25 kJ/mol Joback Calculated Property
Δvap 43.87 kJ/mol Joback Calculated Property
IE 7.76 ± 0.01 eV NIST
logPoct/wat 3.461 Crippen Calculated Property
Pc 2899.85 kPa Joback Calculated Property
Tboil 501.92 K Joback Calculated Property
Tc 738.14 K Joback Calculated Property
Tfus 303.47 K Joback Calculated Property
Vc 0.522 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 340.64 J/mol×K 501.92 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CH3 1
>CH- (ring) 3
-S- (ring) 1
-CH2- (ring) 6

Similar Compounds

4,8-dipropyl-2-thiaadamantane. 4,8-dibutyl-2-thiaadamantane. 4,8-diethyl-2-thiaadamantane. 4,8-dimethyl-2-thiaadamantane. 4-methyl-2-thiaadamantane. 2-Thiatricyclo[3.3.1.1(3,7)]decane. 4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane. cis,trans-2-Methyl-1-thiadecalin. trans, cis-2-Methyl-1-thiadecalin. cis,cis-2-Methyl-1-thiadecalin. Cis-2,3-dimethylthiane. Trans-2,3-dimethylthiane. Trans-2,5-dimethylthiane. Cis-2,5-dimethylthiane. 2-Norbornanethiol, acetate.

Find more compounds similar to 2H-1-Benzothiopyran, octahydro-2-methyl-.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.