Diclofenac epolamine supplier | CasNO.119623-66-4

Name
Diclofenac epolamine
EINECS
CAS No. 119623-66-4
Density
Solubility
Melting Point
Formula C₁₄H₁₁Cl₂NO₂^.C₆H₁₃NO
Boiling Point 412 °C at 760 mmHg
Molecular Weight 410.34
Flash Point 203 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-((2,6-Dichlorophenyl)amino)benzeneacetic acid, compd. with 1-pyrrolidineethanol (1:1);Diclofenac 1-(2-hydroxyethyl)pyrrolidinium salt;Diclofenac hydroxyethylpyrrolidine;Flector;2-[2-[(2,6-dichlorophenyl)amino]phenyl]acetic acid; 2-pyrrolidin-1-ylethanol;Diclofenac-N-(2-hydroxyethyl) pyrrolidine;N-(2-Hydroxyethyl)pyrrolidinium (2-((2,6-dichlorophenyl)amino)phenyl)acetate;Benzeneacetic acid, 2-((2,6-dichlorophenyl)amino)-, compd. with 1-pyrrolidineethanol (1:1);
PSA 60.77000
LogP 4.22370

Diclofenac epolamine Specification

The Diclofenac epolamine, with the CAS registry number 119623-66-4, is also known as Benzeneacetic acid, 2-((2,6-dichlorophenyl)amino)-, compd. with 1-pyrrolidineethanol (1:1). This chemical's molecular formula is C₁₄H₁₁Cl₂NO₂^.C₆H₁₃NO and molecular weight is 410.34. What's more, its systematic name is {2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid - 2-(pyrrolidin-1-yl)ethanol (1:1). Its classification codes are: (1)Analgesics; (2)Analgesics, Non-Narcotic; (3)Anti-Inflammatory Agents; (4)Anti-inflammatory agents, non-steroidal; (5)Antirheumatic Agents; (6)Peripheral Nervous System Agents; (7)Sensory System Agents.

Physical properties of Diclofenac epolamine are: (1)ACD/LogP: 4.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.72; (4)ACD/LogD (pH 7.4): 0.95; (5)ACD/BCF (pH 5.5): 32.53; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 174.87; (8)ACD/KOC (pH 7.4): 2.98; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å²; (13)Flash Point: 203 °C; (14)Enthalpy of Vaporization: 70.07 kJ/mol; (15)Boiling Point: 412 °C at 760 mmHg; (16)Vapour Pressure: 1.59E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)Cc1ccccc1Nc2c(Cl)cccc2Cl.OCCN1CCCC1
(2)Std. InChI: InChI=1S/C14H11Cl2NO2.C6H13NO/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19;8-6-5-7-3-1-2-4-7/h1-7,17H,8H2,(H,18,19);8H,1-6H2
(3)Std. InChIKey: DCERVXIINVUMKU-UHFFFAOYSA-N

Product Name

Diclofenac epolamine

Diclofenac epolamine Specification

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