Chemical Properties of 2-Chlorophenol (CAS 95-57-8)

2-Chlorophenol

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InChI
InChI=1S/C6H5ClO/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChI Key
ISPYQTSUDJAMAB-UHFFFAOYSA-N
Formula
C6H5ClO
SMILES
Oc1ccccc1Cl
Molecular Weight1
128.56
CAS
95-57-8
Other Names
  • 1-Chloro-2-hydroxybenzene
  • 2-Chlorophenol
  • 2-Hydroxychlorobenzene
  • NSC 2870
  • Phenol, o-chloro-
  • Rcra waste number U048
  • o-Chlorophenic acid
  • o-Chlorophenol
  • o-Chlorphenol
Sources

Physical Properties

Property Value Unit Source
Δf -54.50 kJ/mol Joback Calculated Property
Δfgas -123.69 kJ/mol Joback Calculated Property
Δfus 15.32 kJ/mol Joback Calculated Property
Δvap 52.30 ± 0.20 kJ/mol NIST
IE 9.28 eV NIST
logPoct/wat 2.05 Crippen Calculated Property
Pc 5478.85 kPa Joback Calculated Property
Tboil [448.10; 450.00] K Show Hide
Tboil 448.10 K NIST
Tboil 448.90 ± 0.40 K NIST
Tboil 450.00 ± 0.70 K NIST
Tboil 448.15 ± 3.00 K NIST
Tc 721.38 K Joback Calculated Property
Tfus [281.15; 283.00] K Show Hide
Tfus 283.00 ± 0.20 K NIST
Tfus 282.00 ± 0.02 K NIST
Tfus 281.15 ± 2.00 K NIST
Tfus 281.15 ± 0.20 K NIST
Vc 0.28 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 167.36 J/mol×K 481.41 Joback Calculated Property
Cp,liquid 188.70 J/mol×K 283.0 NIST
η 0.00 Pa×s 481.41 Joback Calculated Property
ΔfusH 0.09 kJ/mol 276.0 NIST
ΔfusH 12.52 kJ/mol 283.0 NIST
ΔvapH [45.20; 51.90] kJ/mol [304.50; 401.00] Show Hide
Plot of Enthalpy of vaporization at a given temperature.
ΔvapH 51.90 kJ/mol 304.5 NIST
ΔvapH 45.20 kJ/mol 366.0 NIST
ΔvapH 50.10 kJ/mol 391.0 NIST
ΔvapH 47.00 kJ/mol 392.0 NIST
ΔvapH 47.20 kJ/mol 401.0 NIST
ΔfusS 0.33 J/mol×K 276.0 NIST
ΔfusS 44.24 J/mol×K 283.0 NIST

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 2
-Cl 1
-OH (phenol) 1
=CH- (ring) 4

Similar Compounds

Phenol, 2,6-dichloro-. Phenol, 2,5-dichloro-. 1,4-Benzenediol, 2-chloro-. 1,3-Benzenediol, 4-chloro-. Phenol, 2,4-dichloro-. Phenol, 2,4,6-trichloro-. p-Chlorophenol. Phenol, 3-chloro-. Benzene, 1-chloro-2-methoxy-. 1,4-Benzenediol, 2,5-dichloro-. Phenol, 2,3-dichloro-. 2,6-Dichloro-1,4-benzenediol. Phenol, 2-chloro-5-methyl-. Phenol, 2-chloro-4-methyl-. 2-Chloro-4-fluorophenol.

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