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Benzoic acid,2,5-diamino-

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Name

Benzoic acid,2,5-diamino-

EINECS N/A
CAS No. 610-74-2 Density 1.428 g/cm3
PSA 89.34000 LogP 1.71160
Solubility N/A Melting Point 225 °C(dec.)
Formula C7H8N2O2 Boiling Point 398.1 °C at 760 mmHg
Molecular Weight 152.153 Flash Point 194.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 610-74-2 (2,5-diaminobenzoic acid) Hazard Symbols N/A
Synonyms

2,5-Diaminobenzoicacid;5-Aminoanthranilic acid;

 

Benzoic acid,2,5-diamino- Specification

The Benzoic acid,2,5-diamino-, with the CAS registry number 610-74-2, is also known as 2,5-Diamino-benzoic acid. It belongs to the product category of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. This chemical's molecular formula is C7H8N2O2 and molecular weight is 152.1506. Its systematic name is called 2,5-diaminobenzoic acid.

Physical properties of Benzoic acid,2,5-diamino-: (1)ACD/LogP: -0.24; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -1.58; (4)ACD/LogD (pH 7.4): -2.75; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.71; (13)Molar Refractivity: 41.65 cm3; (14)Molar Volume: 106.5 cm3; (15)Surface Tension: 82.5 dyne/cm; (16)Density: 1.428 g/cm3; (17)Flash Point: 194.6 °C; (18)Enthalpy of Vaporization: 68.4 kJ/mol; (19)Boiling Point: 398.1 °C at 760 mmHg; (20)Vapour Pressure: 4.72E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc(ccc1N)N
(2)InChI: InChI=1/C7H8N2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,8-9H2,(H,10,11)
(3)InChIKey: UONVFNLDGRWLKF-UHFFFAOYAU

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