3-Amino-5-fluorobenzoic acid supplier

Name
Benzoic acid, 3-amino-5-fluoro- (9CI)
EINECS
CAS No. 786616-54-4
Article Data2
CAS DataBase
Density 1.43 g/cm³
Solubility
Melting Point
Formula C₇H₆FNO₂
Boiling Point 355.554 °C at 760 mmHg
Molecular Weight 155.129
Flash Point 168.833 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzoic acid,3-amino-5-fluoro;5-AMINO-3-FLUOROBENZOIC ACID;Benzoic acid,3-amino-5-fluoro-(9CI);
PSA 63.32000
LogP 1.68730

3-Amino-5-fluorobenzoic acid Specification

The Benzoic acid,3-amino-5-fluoro- is an organic compound with the formula C₇H₆FNO₂. The IUPAC name of this chemical is 3-amino-5-fluorobenzoic acid. With the CAS registry number 786616-54-4, the product's categories are Methyl; Halide.

Physical properties about Benzoic acid,3-amino-5-fluoro- are: (1)ACD/LogP: 1.46; (2)ACD/LogD (pH 5.5): 0.029; (3)ACD/LogD (pH 7.4): ; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.487; (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: 1.606; (13)Molar Refractivity: 37.413 cm³; (14)Molar Volume: 108.453 cm³; (15)Polarizability: 14.832×10^-24cm³; (16)Surface Tension: 60.413 dyne/cm; (17)Density: 1.43 g/cm³; (18)Flash Point: 168.833 °C; (19)Enthalpy of Vaporization: 63.388 kJ/mol; (20)Boiling Point: 355.554 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cc(cc1N)F)C(=O)O
(2)InChI: InChI=1/C7H6FNO2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,9H2,(H,10,11)
(3)InChIKey: RYLBYCHERDTVAY-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C7H6FNO2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,9H2,(H,10,11)
(5)Std. InChIKey: RYLBYCHERDTVAY-UHFFFAOYSA-N

Product Name

Benzoic acid, 3-amino-5-fluoro- (9CI)

3-Amino-5-fluorobenzoic acid Specification

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