Chemical Properties of 4-Ethylbenzoyl chloride (CAS 16331-45-6)

4-Ethylbenzoyl chloride

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C9H9ClO/c1-2-7-3-5-8(6-4-7)9(10)11/h3-6H,2H2,1H3
InChI Key
AVTLLLZVYYPGFX-UHFFFAOYSA-N
Formula
C9H9ClO
SMILES
CCc1ccc(C(=O)Cl)cc1
Molecular Weight1
168.62
CAS
16331-45-6
Other Names
  • Benzoyl chloride, 4-ethyl-
Sources

Physical Properties

Property Value Unit Source
Δf -13.17 kJ/mol Joback Calculated Property
Δfgas -132.35 kJ/mol Joback Calculated Property
Δfus 18.51 kJ/mol Joback Calculated Property
Δvap 49.70 kJ/mol Joback Calculated Property
logPoct/wat 2.63 Crippen Calculated Property
Pc 3302.95 kPa Joback Calculated Property
Tboil 528.28 K Joback Calculated Property
Tc 753.10 K Joback Calculated Property
Tfus 309.98 K Joback Calculated Property
Vc 0.49 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 258.49 J/mol×K 528.28 Joback Calculated Property
η 0.00 Pa×s 528.28 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-Cl 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 1
-CH3 1
>C=O (nonring) 1

Similar Compounds

Benzoyl chloride, 4-propyl-. Benzoyl chloride, 4-(1,1-dimethylethyl)-. Benzoyl chloride, 4-butyl-. 4-Methylbenzoic acid chloride. 1,4-Benzenedicarbonyl dichloride. 4-(Chloromethyl)benzoyl chloride. 4-ethylbenzaldehyde. Benzaldehyde, 4-ethyl-. Benzene, 1-chloromethyl-4-ethyl-. Benzoyl chloride. 7-Chloro-p-cymene. Benzaldehyde, 4-(1-methylethyl)-. Ethanone, 1-(4-ethylphenyl)-. Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)-. Ethanone, 1,1'-(1,4-phenylene)bis-.

Find more compounds similar to 4-Ethylbenzoyl chloride.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.