Chemical Properties of cis-1,3-Dimethylcycloheptane (CAS 13151-53-6)

cis-1,3-Dimethylcycloheptane

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InChI
InChI=1S/C9H18/c1-8-5-3-4-6-9(2)7-8/h8-9H,3-7H2,1-2H3/t8-,9+
InChI Key
PTWXFJWKUMXFLI-DTORHVGOSA-N
Formula
C9H18
SMILES
CC1CCCCC(C)C1
Molecular Weight1
126.24
CAS
13151-53-6
Sources

Physical Properties

Property Value Unit Source
Δf 29.54 kJ/mol Joback Calculated Property
Δfgas -201.27 kJ/mol Joback Calculated Property
Δfus 9.87 kJ/mol Joback Calculated Property
Δvap 35.92 kJ/mol Joback Calculated Property
IE 10.41 eV NIST
IE 10.41 ± 0.05 eV NIST
logPoct/wat 3.223 Crippen Calculated Property
Pc 2814.34 kPa Joback Calculated Property
Tboil 424.47 K Joback Calculated Property
Tc 631.20 K Joback Calculated Property
Tfus 190.81 K Joback Calculated Property
Vc 0.464 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 254.42 J/mol×K 424.47 Joback Calculated Property
η 0.0002362 Pa×s 424.47 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CH3 2
>CH- (ring) 2
-CH2- (ring) 5

Similar Compounds

trans-1,3-Dimethylcycloheptane. Undecane, 4,6-dimethyl-. Octane, 3,5-dimethyl-. Tridecane, 4,6,8,10-tetramethyl, # 4. 2,4-dimethyloctane. 2,4-Dimethyloctacosane. Dodecane, 4,6-dimethyl-. trans-1,3-Dimethylcyclooctane. 3,5-dimethyloctane, erythro. cis-1,3-Dimethylcyclooctane. 17,19,23-trimethylheptatriacontane. 3,5-Dimethyldodecane. 2,4-dimethylnonane. Eicosane, 2,4-dimethyl-. Decane, 2,4,6-trimethyl-.

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