Chemical Properties of Propanoic acid, 3-chloro-, propyl ester (CAS 62108-66-1)

Propanoic acid, 3-chloro-, propyl ester

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InChI
InChI=1S/C6H11ClO2/c1-2-5-9-6(8)3-4-7/h2-5H2,1H3
InChI Key
WIOAODPBBXZVNV-UHFFFAOYSA-N
Formula
C6H11ClO2
SMILES
CCCOC(=O)CCCl
Molecular Weight1
150.60
CAS
62108-66-1
Other Names
  • n-Propyl-3-chloropropionate
  • propyl 3-chloropropionate
Sources

Physical Properties

Property Value Unit Source
Δcliquid -3419.20 ± 8.40 kJ/mol NIST
Δcliquid -3479.00 ± 4.00 kJ/mol NIST
Δcliquid -3413.00 kJ/mol NIST
Δf -246.21 kJ/mol Joback Calculated Property
Δfgas -485.80 ± 9.60 kJ/mol NIST
Δfliquid -537.60 ± 8.40 kJ/mol NIST
Δfus 18.28 kJ/mol Joback Calculated Property
Δvap 51.90 ± 4.20 kJ/mol NIST
logPoct/wat 1.57 Crippen Calculated Property
Pc 3138.51 kPa Joback Calculated Property
Tboil 450.40 K Joback Calculated Property
Tc 634.77 K Joback Calculated Property
Tfus 259.46 K Joback Calculated Property
Vc 0.44 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 224.90 J/mol×K 450.4 Joback Calculated Property
η 0.00 Pa×s 450.4 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
-CH2- 4
-Cl 1
-CH3 1

Similar Compounds

Ethyl 3-chloropropionate. n-Butyl-3-chloropropionate. 1-Propanol, 3-chloro, propanoate. Isobutyl 3-chloropropionate. Propanoic acid, 3-chloro, 3-butenyl ester. 3-Chloropropionic acid, pentyl ester. 3-Methylbutyl 3-chloropropionate. Propanoic acid, propyl ester. 3-Chloropropionic acid, hexyl ester. 1-Propanol, 3-chloro, 2-methylpropanoate. 1-Propanol, 3-chloro, butanoate. 3-Chloropropanoic acid, 2-butyl ester. Propyl 3-chlorobutanoate. Propanoic acid, 3-chloro-, 1-methylethyl ester. 3-Chloropropionic acid, heptyl ester.

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