Chemical Properties of Propanoic acid, 3-chloro- (CAS 107-94-8)

Propanoic acid, 3-chloro-

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InChI
InChI=1S/C3H5ClO2/c4-2-1-3(5)6/h1-2H2,(H,5,6)
InChI Key
QEYMMOKECZBKAC-UHFFFAOYSA-N
Formula
C3H5ClO2
SMILES
O=C(O)CCCl
Molecular Weight1
108.52
CAS
107-94-8
Other Names
  • 3-Chloropropanoic acid
  • 3-Chloropropionic acid
  • Propionic acid, 3-chloro-
  • «beta»-Chloropropionic acid
  • «beta»-Monochloropropionic acid
Sources

Physical Properties

Property Value Unit Source
Δcsolid -1370.00 ± 3.00 kJ/mol NIST
Δcsolid -1366.00 kJ/mol NIST
Δf -303.29 kJ/mol Joback Calculated Property
Δfgas -385.80 kJ/mol Joback Calculated Property
Δfus 13.41 kJ/mol Joback Calculated Property
Δvap 50.08 kJ/mol Joback Calculated Property
logPoct/wat 0.70 Crippen Calculated Property
Pc 5190.64 kPa Joback Calculated Property
Tboil 477.20 K NIST
Tc 633.22 K Joback Calculated Property
Tfus 314.00 ± 4.00 K NIST
Vc 0.28 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 130.07 J/mol×K 451.52 Joback Calculated Property
η 0.00 Pa×s 451.52 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CH2- 2
>C=O (nonring) 1
-OH (alcohol) 1
-Cl 1

Similar Compounds

Propanoic acid, 3-chloro-, methyl ester. Lithium propionate. EtCO2 anion. Potassium propionate. Sodium propionate. sodium propionate. Propanoic acid. Butanoic acid, 3-chloro-. Cis-3-chlorocrotonic acid. Alpha,beta-dichloropropionic acid. Butanoic acid, 4-chloro-. (S)-(-)-2-Chloropropionic acid. Propanoic acid, 2-chloro-. 1-Propanol, 3-chloro-. Ethyl 3-chloropropionate.

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