(2-BENZIMIDAZOLYLTHIO)ACETIC ACID HYDRAZIDE

The Acetic acid,2-(1H-benzimidazol-2-ylthio)-, hydrazide, with the CAS registry number 30065-27-1, is also known as ZINC00039853. This chemical's molecular formula is C₉H₁₀N₄OS and molecular weight is 222.2669. Its IUPAC name is called 2-(1H-benzimidazol-2-ylsulfanyl)acetohydrazide.

Physical properties of Acetic acid,2-(1H-benzimidazol-2-ylthio)-, hydrazide: (1)ACD/LogP: 0.76; (2)ACD/LogD (pH 5.5): 0.68; (3)ACD/LogD (pH 7.4): 0.76; (4)ACD/BCF (pH 5.5): 1.85; (5)ACD/BCF (pH 7.4): 2.23; (6)ACD/KOC (pH 5.5): 51.17; (7)ACD/KOC (pH 7.4): 61.66; (8)#H bond acceptors: 5; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.729; (12)Molar Refractivity: 60.69 cm³; (13)Molar Volume: 152.1 cm³; (14)Surface Tension: 84.3 dyne/cm; (15)Density: 1.46 g/cm³.

Preparation: this chemical can be prepared by (1H-benzoimidazol-2-ylsulfanyl)-acetic acid ethyl ester. This reaction will need reagent N₂H₄+H₂O.

Uses of Acetic acid,2-(1H-benzimidazol-2-ylthio)-, hydrazide: it can be used to produce 2-(1H-benzoimidazol-2-ylsulfanyl)-acetic acid pyridin-3-ylmethylene-hydrazide by heating. This reaction will need solvent methanol with reaction time of 10 hours. The yield is about 74%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)NC(=N2)SCC(=O)NN
(2)InChI: InChI=1S/C9H10N4OS/c10-13-8(14)5-15-9-11-6-3-1-2-4-7(6)12-9/h1-4H,5,10H2,(H,11,12)(H,13,14)
(3)InChIKey: UIHKXOZJFOTOCE-UHFFFAOYSA-N