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CAS No.: | 6295-18-7 |
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Name: | 2-amino-4-arsonobenzoic acid |
Molecular Structure: | |
Formula: | C7H8AsNO5 |
Molecular Weight: | 261.066 |
Synonyms: | Anthranilic acid, 4-arsono- (8CI);NSC 11812;2-Amino-4-arsonobenzoic acid;4-Arsonoanthranilic acid; |
Boiling Point: | 636.8 °C at 760 mmHg |
Flash Point: | 338.9 °C |
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The Benzoicacid, 2-amino-4-arsonoyl-, with the CAS registry number 6295-18-7, is also known as 4-Arsonoanthranilic acid. This chemical's molecular formula is C7H8AsNO5 and molecular weight is 261.06. What's more, its systematic name is 2-Amino-4-arsonobenzoic acid.
Physical properties of Benzoicacid, 2-amino-4-arsonoyl- are: (1)ACD/LogP: -1.01; (2)# of Rule of 5 Violations: 1; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 6; (8)#H bond donors: 5; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 65.07 Å2; (11)Flash Point: 338.9 °C; (12)Enthalpy of Vaporization: 98.88 kJ/mol; (13)Boiling Point: 636.8 °C at 760 mmHg; (14)Vapour Pressure: 4.32E-17 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1ccc(cc1N)[As](=O)(O)O
(2)InChI: InChI=1/C7H8AsNO5/c9-6-3-4(8(12,13)14)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11)(H2,12,13,14)
(3)InChIKey: FONAQXOHXLIQHK-UHFFFAOYSA-N