Benzoic acid,2-[[4-(trifluoromethyl)phenyl]amino]- supplier

Name
N-(4-TRIFLUOROMETHYLPHENYL)ANTHRANILIC ACID
EINECS
CAS No. 57975-93-6
Article Data3
CAS DataBase
Density 1.396 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₀F₃NO₂
Boiling Point 380.46 °C at 760 mmHg
Molecular Weight 281.234
Flash Point 183.896 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-{[4-(trifluoromethyl)phenyl]amino}benzoic acid;benzoic acid, 2-[[4-(trifluoromethyl)phenyl]amino]-;N-(4-trifluoromethylphenyl)anthranilic acid;N-(4-trifluoromethylphenyl)anthranilicacid;
PSA 49.33000
LogP 4.22020

Benzoic acid,2-[[4-(trifluoromethyl)phenyl]amino]- Specification

The Benzoic acid,2-[[4-(trifluoromethyl)phenyl]amino]-, with the CAS registry number 57975-93-6, has the systematic name of 2-{[4-(trifluoromethyl)phenyl]amino}benzoic acid. And the molecular formula of this chemical is C₁₄H₁₀F₃NO₂. In addition, it belongs to the product category of Pharmacetical.

The physical properties of Benzoic acid,2-[[4-(trifluoromethyl)phenyl]amino]- are as following: (1)ACD/LogP: 4.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 110; (6)ACD/BCF (pH 7.4): 7; (7)ACD/KOC (pH 5.5): 300; (8)ACD/KOC (pH 7.4): 19; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 49.33 Å²; (13)Index of Refraction: 1.585; (14)Molar Refractivity: 67.537 cm³; (15)Molar Volume: 201.514 cm³; (16)Polarizability: 26.774×10^-24cm³; (17)Surface Tension: 44.323 dyne/cm; (18)Density: 1.396 g/cm³; (19)Flash Point: 183.896 °CEnthalpy of Vaporization: 66.309 kJ/mol; (20)Boiling Point: 380.46 °C at 760 mmHgVapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1ccc(cc1)Nc2ccccc2C(O)=O
(2)InChI: InChI=1/C14H10F3NO2/c15-14(16,17)9-5-7-10(8-6-9)18-12-4-2-1-3-11(12)13(19)20/h1-8,18H,(H,19,20)
(3)InChIKey: JJJNSBXSKROGOM-UHFFFAOYAA

Product Name

N-(4-TRIFLUOROMETHYLPHENYL)ANTHRANILIC ACID

Benzoic acid,2-[[4-(trifluoromethyl)phenyl]amino]- Specification

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