Chemical Properties of Benzene, (3-octylundecyl)- (CAS 5637-96-7)

Benzene, (3-octylundecyl)-

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InChI
InChI=1S/C25H44/c1-3-5-7-9-11-14-18-24(19-15-12-10-8-6-4-2)22-23-25-20-16-13-17-21-25/h13,16-17,20-21,24H,3-12,14-15,18-19,22-23H2,1-2H3
InChI Key
YFDREPVYVBGJDD-UHFFFAOYSA-N
Formula
C25H44
SMILES
CCCCCCCCC(CCCCCCCC)CCc1ccccc1
Molecular Weight1
344.62
CAS
5637-96-7
Other Names
  • 3-Octyl-1-phenylundecane
  • 9-(2'-Phenylethyl)heptadecane
  • 9-(2-Phenylethyl)heptadecane
  • Heptadecane, 9-phenethyl-
Sources

Physical Properties

Property Value Unit Source
Δf 269.59 kJ/mol Joback Calculated Property
Δfgas -328.08 kJ/mol Joback Calculated Property
Δfus 51.02 kJ/mol Joback Calculated Property
Δvap 73.13 kJ/mol Joback Calculated Property
logPoct/wat 8.74 Crippen Calculated Property
Pc 930.07 kPa Joback Calculated Property
Tboil 797.64 K Joback Calculated Property
Tc 984.29 K Joback Calculated Property
Tfus 246.45 ± 0.50 K NIST
Vc 1.32 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1069.77 J/mol×K 797.64 Joback Calculated Property
η 0.00 Pa×s 797.64 Joback Calculated Property
ΔvapH 88.30 kJ/mol 480.5 NIST
ΔvapH 89.40 kJ/mol 494.5 NIST

Molecular Descriptors

Joback and Reid Groups
>CH- 1
=C< (ring) 1
-CH2- 16
-CH3 2
=CH- (ring) 5

Similar Compounds

Benzene, [6-cyclopentyl-3-(3-cyclopentylpropyl)hexyl]-. Undecane, 3-phenethyl-1-phenyl-. Benzene, (2-cyclohexylethyl)-. Benzene, [3-(2-cyclohexylethyl)-6-cyclopentylhexyl]-. Benzene, 1,1'-[4-(3-phenylpropyl)-1,7-heptanediyl]bis-. Benzene, 3-ethylpentyl. Benzene, (3-cyclopentylpropyl)-. Benzene, (3-methylpentyl)-. Benzene, (2-decyldodecyl)-. Benzene, hexadecyl-. Decane, 1,10-diphenyl-. n-Octylbenzene. 1-Phenyleicosane. Benzene, tetradecyl-. Benzene, nonadecyl-.

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