Chemical Properties of 1H-Indene, octahydro-, cis- (CAS 4551-51-3)

1H-Indene, octahydro-, cis-

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InChI
InChI=1S/C9H16/c1-2-5-9-7-3-6-8(9)4-1/h8-9H,1-7H2/t8-,9+
InChI Key
BNRNAKTVFSZAFA-DTORHVGOSA-N
Formula
C9H16
SMILES
C1CC2CCCCC2C1
Molecular Weight1
124.22
CAS
4551-51-3
Other Names
  • Indan, hexahydro-, cis-
  • Indene, octahydro-, cis-
  • Octahydro-1H-indene, cis
  • cis-Bicyclo[4.3.0]Nonane
  • cis-Hexahydroindan
  • cis-Hydrindan
  • cis-Hydrindane
  • cis-Octahydro-1H-indene
  • cis-Perhydroindene
  • cis-hexahydrindan
Sources

Physical Properties

Property Value Unit Source
Δcliquid -5655.10 ± 1.50 kJ/mol NIST
Δcliquid -5646.70 ± 5.90 kJ/mol NIST
Δf 110.10 kJ/mol Joback Calculated Property
Δfgas -127.20 ± 2.00 kJ/mol NIST
Δfliquid -173.30 ± 1.50 kJ/mol NIST
Δfus 9.04 kJ/mol Joback Calculated Property
Δvap 46.00 ± 1.30 kJ/mol NIST
Δvap 46.10 kJ/mol NIST
IE 9.46 ± 0.06 eV NIST
IE 9.50 ± 0.00 eV NIST
IE 10.13 ± 0.03 eV NIST
logPoct/wat 2.98 Crippen Calculated Property
Pc 3276.53 kPa Joback Calculated Property
liquid 265.47 J/mol×K NIST
Tboil [437.00; 441.07] K Show Hide
Tboil 441.07 ± 0.20 K NIST
Tboil 441.07 ± 0.50 K NIST
Tboil 440.97 ± 0.50 K NIST
Tboil 441.01 ± 0.25 K NIST
Tboil 440.89 ± 0.30 K NIST
Tboil 440.93 ± 0.30 K NIST
Tboil 440.93 ± 0.40 K NIST
Tboil 441.01 ± 0.20 K NIST
Tboil Outlier 437.00 ± 3.00 K NIST
Tc 647.88 K Joback Calculated Property
Tfus [235.93; 236.45] K Show Hide
Tfus 236.45 ± 0.30 K NIST
Tfus 236.28 ± 0.10 K NIST
Tfus 236.30 ± 0.10 K NIST
Tfus 236.45 ± 0.75 K NIST
Tfus Outlier 235.93 ± 0.15 K NIST
Tfus 236.28 ± 0.10 K NIST
Tfus 236.30 ± 0.08 K NIST
Tfus 236.45 ± 0.05 K NIST
Ttriple 236.48 ± 0.01 K NIST
Vc 0.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 240.94 J/mol×K 431.61 Joback Calculated Property
Cp,liquid 214.18 J/mol×K 298.15 NIST
η 0.00 Pa×s 431.61 Joback Calculated Property
ΔfusH 8.26 kJ/mol 182.3 NIST
ΔfusH 0.39 kJ/mol 184.5 NIST
ΔfusH 1.40 kJ/mol 236.5 NIST
ΔvapH [41.90; 47.10] kJ/mol [278.00; 413.00] Show Hide
ΔvapH 47.10 kJ/mol 278.0 NIST
ΔvapH 45.90 kJ/mol 328.0 NIST
ΔvapH 42.60 kJ/mol 396.0 NIST
ΔvapH 41.90 kJ/mol 413.0 NIST
ΔfusS 45.33 J/mol×K 182.3 NIST
ΔfusS 2.13 J/mol×K 184.5 NIST
ΔfusS 5.91 J/mol×K 236.5 NIST

Molecular Descriptors

Joback and Reid Groups
>CH- (ring) 2
-CH2- (ring) 7

Similar Compounds

1H-Indene, octahydro-. 1H-Indene, octahydro-, trans-. Bicyclo[4.3.0]nonane, isomer # 2. Bicyclo[4.3.0]nonane, isomer # 1. Cyclopentylcyclohexane. trans-1-Methyl-2-propylcyclopentane. cis-1-Methyl-2-propylcyclopentane. Cyclopentane, 1-methyl-2-propyl-. Cyclopentane, 1-butyl-2-methyl, cis. Cyclopentane, 1-butyl-2-methyl, trans. Cyclopentane, 1-butyl-2-methyl. Cyclopentane, 1-butyl-2-ethyl-. Cyclopentane, 1-methyl-2-pentyl, trans. Cyclopentane, 1-methyl-2-pentyl, cis. Cyclopentane, 1-methyl-2-(4-methylpentyl)-, trans-.

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.