Ethyl 2,4-dichlorobenzoate supplier

Name
Ethyl 2,4-dichlorobenzoate
EINECS
CAS No. 56882-52-1
Article Data32
CAS DataBase
Density 1.305 g/cm³
Solubility
Melting Point
Formula C₉H₈Cl₂O₂
Boiling Point 272.8 °C at 760 mmHg
Molecular Weight 219.067
Flash Point 111.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms ETHYL-2,4-DICHLOROBENZOATE;Benzoic acid, 2,4-dichloro-, ethyl ester;
PSA 26.30000
LogP 3.17010

Ethyl 2,4-dichlorobenzoate Specification

The Ethyl 2,4-dichlorobenzoate, with CAS registry number 56882-52-1, has the systematic name of ethyl 2,4-dichlorobenzoate. Besides this, it is also called benzoic acid, 2,4-dichloro-, ethyl ester. And the chemical formula of this chemical is C₉H₈Cl₂O₂.

Physical properties of Ethyl 2,4-dichlorobenzoate: (1)ACD/LogP: 3.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.59; (4)ACD/LogD (pH 7.4): 3.59; (5)ACD/BCF (pH 5.5): 314.97; (6)ACD/BCF (pH 7.4): 314.97; (7)ACD/KOC (pH 5.5): 2137.33; (8)ACD/KOC (pH 7.4): 2137.33; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.537; (14)Molar Refractivity: 52.44 cm³; (15)Molar Volume: 167.7 cm³; (16)Polarizability: 20.79×10^-24cm³; (17)Surface Tension: 40.6 dyne/cm; (18)Density: 1.305 g/cm³; (19)Flash Point: 111.8 °C; (20)Enthalpy of Vaporization: 51.11 kJ/mol; (21)Boiling Point: 272.8 °C at 760 mmHg; (22)Vapour Pressure: 0.00595 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)c1ccc(Cl)cc1Cl
(2)InChI: InChI=1/C9H8Cl2O2/c1-2-13-9(12)7-4-3-6(10)5-8(7)11/h3-5H,2H2,1H3
(3)InChIKey: ZBBGAUHWTZKKQQ-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C9H8Cl2O2/c1-2-13-9(12)7-4-3-6(10)5-8(7)11/h3-5H,2H2,1H3
(5)Std. InChIKey: ZBBGAUHWTZKKQQ-UHFFFAOYSA-N

Product Name

Ethyl 2,4-dichlorobenzoate

Ethyl 2,4-dichlorobenzoate Specification

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