Aceclofenac methyl ester supplier

Name
Aceclofenac Methyl Ester
EINECS
CAS No. 139272-66-5
Article Data3
CAS DataBase
Density 1.37 g/cm³
Solubility
Melting Point 108-109°C
Formula C₁₇H₁₅Cl₂NO₄
Boiling Point 448.373 °C at 760 mmHg
Molecular Weight 368.216
Flash Point 224.968 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (2-Methoxy-2-oxo-ethyl) 2-[2-(2,6-dichloroanilino)phenyl]acetate;
PSA 64.63000
LogP 4.06870

Aceclofenac methyl ester Specification

The CAS registry number of Benzeneacetic acid, 2-[(2,6-dichlorophenyl)amino]-,2-methoxy-2-oxoethyl ester is 139272-66-5. In addition, the molecular formula is C₁₇H₁₅Cl₂NO₄ and the molecular weight is 367.04. The systematic name is (2-methoxy-2-oxo-ethyl) 2-[2-(2,6-dichloroanilino)phenyl]acetate. What's more, it should be stored in sealed container, and put in a cool and dry place.

Physical properties about Benzeneacetic acid, 2-[(2,6-dichlorophenyl)amino]-,2-methoxy-2-oxoethyl ester are: (1)ACD/LogP: 3.96; (2)ACD/LogD (pH 5.5): 3.955; (3)ACD/LogD (pH 7.4): 3.955; (4)ACD/BCF (pH 5.5): 596.796; (5)ACD/BCF (pH 7.4): 596.796; (6)ACD/KOC (pH 5.5): 3377.058; (7)ACD/KOC (pH 7.4): 3377.058; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 8; (11)Polar Surface Area: 64.63 Å²; (12)Index of Refraction: 1.604; (13)Molar Refractivity: 92.415 cm³; (14)Molar Volume: 268.677 cm³; (15)Polarizability: 36.636 10^-24cm³; (16)Surface Tension: 50.935 dyne/cm; (17)Density: 1.37 g/cm³; (18)Flash Point: 224.968 °C; (19)Enthalpy of Vaporization: 70.688 kJ/mol; (20)Boiling Point: 448.373 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: COC(=O)COC(=O)Cc1ccccc1Nc2c(cccc2Cl)Cl
(2)InChI: InChI=1/C17H15Cl2NO4/c1-23-16(22)10-24-15(21)9-11-5-2-3-8-14(11)20-17-12(18)6-4-7-13(17)19/h2-8,20H,9-10H2,1H3
(3)InChIKey: CYRWXOBAPNKPIF-UHFFFAOYAS

Product Name

Aceclofenac Methyl Ester

Aceclofenac methyl ester Specification

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