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CAS No.: | 926264-77-9 |
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Name: | Benzoic acid, 5-[(3,5-dimethoxybenzoyl)amino]-2-hydroxy- |
Molecular Structure: | |
Formula: | C16H15NO6 |
Molecular Weight: | 317.29 |
Synonyms: | 5-[(3,5-dimethoxybenzoyl)amino]-2-hydroxybenzoic acid; |
Density: | 1.396 g/cm3 |
Boiling Point: | 477.478 °C at 760 mmHg |
Flash Point: | 242.57 °C |
PSA: | 105.09000 |
LogP: | 2.43290 |
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The CAS registry number of Benzoicacid, 5-[(3,5-dimethoxybenzoyl)amino]-2-hydroxy- is 926264-77-9. The systematic name is 5-[(3,5-dimethoxybenzoyl)amino]-2-hydroxybenzoic acid. In addition, the molecular formula is C16H15NO6 and the molecular weight is 317.29. It should be stored in a cool and dry place.
Physical properties about Benzoicacid, 5-[(3,5-dimethoxybenzoyl)amino]-2-hydroxy- are: (1)ACD/LogP: 3.21; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 7; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 6; (9)Polar Surface Area: 105.09 Å2; (10)Index of Refraction: 1.651; (11)Molar Refractivity: 82.997 cm3; (12)Molar Volume: 227.268 cm3; (13)Polarizability: 32.903 ×10-24cm3; (14)Surface Tension: 61.862 dyne/cm; (15)Density: 1.396 g/cm3; (16)Flash Point: 242.57 °C; (17)Enthalpy of Vaporization: 78.099 kJ/mol; (18)Boiling Point: 477.478 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc(ccc1O)NC(=O)c2cc(OC)cc(OC)c2
(2)InChI: InChI=1/C16H15NO6/c1-22-11-5-9(6-12(8-11)23-2)15(19)17-10-3-4-14(18)13(7-10)16(20)21/h3-8,18H,1-2H3,(H,17,19)(H,20,21)
(3)InChIKey: VHQWYZLUFWOMBU-UHFFFAOYAF