Chemical Properties of Heptane, 1-chloro- (CAS 629-06-1)

Heptane, 1-chloro-

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InChI
InChI=1S/C7H15Cl/c1-2-3-4-5-6-7-8/h2-7H2,1H3
InChI Key
DZMDPHNGKBEVRE-UHFFFAOYSA-N
Formula
C7H15Cl
SMILES
CCCCCCCCl
Molecular Weight1
134.65
CAS
629-06-1
Other Names
  • 1-Chloroheptane
  • Heptyl chloride
  • n-Heptyl chloride
Sources

Physical Properties

Property Value Unit Source
Δf -3.87 kJ/mol Joback Calculated Property
Δfgas -203.55 kJ/mol Joback Calculated Property
Δfus 18.08 kJ/mol Joback Calculated Property
Δvap [47.00; 47.90] kJ/mol Show Hide
Δvap 47.68 kJ/mol NIST
Δvap 47.90 kJ/mol NIST
Δvap 47.00 kJ/mol NIST
Δvap 47.70 ± 0.10 kJ/mol NIST
Δvap 47.66 ± 0.10 kJ/mol NIST
IE 10.15 eV NIST
logPoct/wat 3.20 Crippen Calculated Property
Pc 2693.00 kPa Joback Calculated Property
Tboil 432.20 K NIST
Tboil 433.15 ± 0.30 K NIST
Tboil 431.55 ± 1.00 K NIST
Tc 568.65 K Joback Calculated Property
Tfus 203.65 ± 0.40 K NIST
Vc 0.48 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 223.23 J/mol×K 396.99 Joback Calculated Property
Cp,liquid 245.40 J/mol×K 298.15 NIST
η 0.00 Pa×s 396.99 Joback Calculated Property
ΔvapH 46.90 kJ/mol 370.5 NIST
ΔvapH 45.10 kJ/mol 394.0 NIST

Molecular Descriptors

Joback and Reid Groups
-CH2- 6
-Cl 1
-CH3 1

Similar Compounds

1,7-Dichloroheptane. Behenyl chloride. Decane, 1-chloro-. 1,10-Dichlorodecane. Nonadecane, 1-chloro-. 1-CHLOROICOSANE. DODECANE, 1-CHLORO-. 1,8-Dichlorooctane. Octane, 1-chloro-. Octadecane, 1-chloro-. Tetradecane, 1-chloro-. Hexadecane, 1-chloro-. Nonane, 1-chloro-. 1-chlorotetracosane. HEPTACOSANE, 1-CHLORO-.

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