CAS No.39635-11-5,3,4-DIHYDROXYBENZHYDRAZIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	39635-11-5
Name:	3,4-DIHYDROXYBENZHYDRAZIDE
Article Data:	11

Formula:	C₇H₈N₂O₃
Molecular Weight:	168.152
Synonyms:	Protocatechuicacid, hydrazide (6CI);3,4-Dihydroxybenzoic acid hydrazide;3,4-Dihydroxybenzoyl hydrazide;3,4-Dihydroxybenzoylhydrazine;
EINECS:	254-550-3
Density:	1.477 g/cm³
Melting Point:	268 °C
Hazard Symbols:	Xi
Risk Codes:	22-36
PSA:	95.58000
LogP:	0.79250

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Specification

The CAS register number of Benzoicacid, 3,4-dihydroxy-, hydrazide is 39635-11-5. It also can be called as 3,4-Dihydroxybenzoic acid hydrazide and the IUPAC name about this chemical is 3,4-dihydroxybenzohydrazide. The molecular formula about this chemical is C₇H₈N₂O₃ and the molecular weight is 168.15. It belongs to the Aromatic Hydrazides, Hydrazines, Hydrazones and Oximes.

Physical properties about Benzoicacid, 3,4-dihydroxy-, hydrazide are: (1)ACD/LogP: -0.52; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -0.53; (4)ACD/LogD (pH 7.4): -0.61; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 12.29; (8)ACD/KOC (pH 7.4): 10.04; (9)#H bond acceptors: 5; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 42.01Å²; (13)Index of Refraction: 1.67; (14)Molar Refractivity: 42.54 cm³; (15)Molar Volume: 113.8 cm³; (16)Polarizability: 16.86x10^-24cm³; (17)Surface Tension: 79.3 dyne/cm.

Uses of Benzoicacid, 3,4-dihydroxy-, hydrazide: it can be used to produce 3,4-dihydroxy-N-(4-thioxo-4H-pyridin-1-yl)-benzamide with pyran-4-thione at ambient temperature. This reaction will need solvent dimethylformamide with reaction time of 24 hours. The yield is about 51%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1cc(O)c(O)cc1)NN
(2)InChI: InChI=1/C7H8N2O3/c8-9-7(12)4-1-2-5(10)6(11)3-4/h1-3,10-11H,8H2,(H,9,12)
(3)InChIKey: WGXWEXNJRZMIPT-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C7H8N2O3/c8-9-7(12)4-1-2-5(10)6(11)3-4/h1-3,10-11H,8H2,(H,9,12)
(5)Std. InChIKey: WGXWEXNJRZMIPT-UHFFFAOYSA-N