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Basic Information
CAS No.: 62-48-6
Name: 2-Sulfanyl-N'-(sulfanylacetyl)acetohydrazide
Molecular Structure:
Molecular Structure of 62-48-6 (2-Sulfanyl-N'-(sulfanylacetyl)acetohydrazide)
Formula: C4H8N2O2S2
Molecular Weight: 180.2485
Synonyms: N,N'-Bis(mercaptoacetyl) hydrazine;NSC 209421;
Density: 1.339 g/cm3
Boiling Point: 446.8 °C at 760 mmHg
Flash Point: 224 °C
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    Product Name: Mercaptoacetic acid 2-(mercaptoacetyl)hydrazide Synonyms: 1,2-Bis(2-mercaptoacetyl)hydrazine;Mercaptoacetic acid 2-(mercaptoacetyl)hydrazide;NSC 209421;NSC 222822 CAS: 62-48-6 MF: C4H8N2O2S2 MW: 180.24852 Appearance:white powd

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Specification

The 2-Sulfanyl-N'-(sulfanylacetyl)acetohydrazide, with the CAS registry number 62-48-6, is also known as N, N'-Bis(mercaptoacetyl) hydrazine. This chemical's molecular formula is C4H8N2O2S2 and molecular weight is 180.2485. What's more, its IUPAC name is 2-Sulfanyl-N'-(sulfanylacetyl)acetohydrazide.

Physical properties about 2-Sulfanyl-N'-(sulfanylacetyl)acetohydrazide are: (1)ACD/LogP: -0.34; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 15.42; (6)ACD/KOC (pH 7.4): 10.57; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 91.22 Å2; (11)Index of Refraction: 1.561; (12)Molar Refractivity: 43.62 cm3; (13)Molar Volume: 134.5 cm3; (14)Polarizability: 17.29×10-24 cm3; (15)Surface Tension: 51.8 dyne/cm; (16)Density: 1.339 g/cm3; (17)Flash Point: 224 °C; (18)Enthalpy of Vaporization: 70.51 kJ/mol; (19)Boiling Point: 446.8 °C at 760 mmHg; (20)Vapour Pressure: 3.53E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(NNC(=O)CS)CS
(2) InChI: InChI=1/C4H8N2O2S2/c7-3(1-9)5-6-4(8)2-10/h9-10H,1-2H2,(H,5,7)(H,6,8)
(3) InChIKey: SJMLATCMQNTURW-UHFFFAOYAB