Benzoic acid, 2-amino-3,5-difluoro- supplier

Name
2-amino-3,5-difluorobenzoic acid
EINECS
CAS No. 126674-78-0
Article Data3
CAS DataBase
Density 1.537 g/cm³
Solubility
Melting Point
Formula C₇H₅F₂NO₂
Boiling Point 291.793 °C at 760 mmHg
Molecular Weight 173.119
Flash Point 130.272 °C
Transport Information
Appearance white crystal powder
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-3,5-difluorobenzoic acid;
PSA 63.32000
LogP 1.82640

Benzoic acid, 2-amino-3,5-difluoro- Specification

The Benzoic acid, 2-amino-3,5-difluoro- has the CAS registry number 126674-78-0. This chemical's molecular formula is C₇H₅F₂NO₂ and molecular weight is 173.12. What's more, its systematic name is 2-amino-3,5-difluorobenzoic acid.

Physical properties of Benzoic acid, 2-amino-3,5-difluoro- are: (1)ACD/LogP: 2.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 10; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 63.32 Å²; (12)Index of Refraction: 1.578; (13)Molar Refractivity: 37.407 cm³; (14)Molar Volume: 112.663 cm³; (15)Polarizability: 14.829×10^-24cm³; (16)Surface Tension: 56.942 dyne/cm; (17)Density: 1.537 g/cm³; (18)Flash Point: 130.272 °C; (19)Enthalpy of Vaporization: 56.105 kJ/mol; (20)Boiling Point: 291.793 °C at 760 mmHg; (21)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(C(O)=O)c(N)c(F)c1
(2)InChI: InChI=1S/C7H5F2NO2/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2H,10H2,(H,11,12)
(3)InChIKey: NORJRQVQTYNLAO-UHFFFAOYSA-N

Product Name

2-amino-3,5-difluorobenzoic acid

Benzoic acid, 2-amino-3,5-difluoro- Specification

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