Name: 2-NITROBENZENESULFONYL HYDRAZINE
SKU: 6655-77-2

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Basic Information

Molecular Structure:
CAS No.:	6655-77-2
Name:	2-NITROBENZENESULFONYL HYDRAZINE
Article Data:	22

Formula:	C₆H₇N₃O₄S
Molecular Weight:	217.205
Synonyms:	Benzenesulfonicacid, m-nitro-, hydrazide (7CI,8CI);3-Nitrobenzenesulfonic acid hydrazide;3-Nitrobenzenesulfonyl hydrazide;NSC 268248;m-Nitrobenzenesulfonic acidhydrazide;m-Nitrobenzenesulfonyl hydrazide;
Density:	1.562 g/cm³
Boiling Point:	421.8 °C at 760 mmHg
Flash Point:	208.9 °C
PSA:	126.39000
LogP:	2.44200

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Specification

The CAS registry number of Benzenesulfonic acid,3-nitro-, hydrazide is 6655-77-2. This chemical is also named as Benzenesulfonohydrazide, 3-nitro-. In addition, its molecular formula is C₆H₇N₃O₄S and molecular weight is 217.2. Its systematic name and IUPAC name are the same which is called 3-nitrobenzenesulfonohydrazide.

Physical properties about Benzenesulfonic acid,3-nitro-, hydrazide are: (1)ACD/LogP: 0.08; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 7; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 3; (6)Index of Refraction: 1.62; (7)Molar Refractivity: 48.87 cm³; (8)Molar Volume: 139 cm³; (9)Surface Tension: 67.3 dyne/cm; (10)Density: 1.562 g/cm³; (11)Flash Point: 208.9 °C; (12)Enthalpy of Vaporization: 67.58 kJ/mol; (13)Boiling Point: 421.8 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(NN)c1cc([N+]([O-])=O)ccc1
(2)InChI: InChI=1/C6H7N3O4S/c7-8-14(12,13)6-3-1-2-5(4-6)9(10)11/h1-4,8H,7H2
(3)InChIKey: IHLRXXTYALIWND-UHFFFAOYAS