4-(2-FURFURYL)-3-THIOSEMICARBAZIDE

The Hydrazinecarbothioamide,N-(2-furanylmethyl)- is an organic compound with the formula C₆H₉N₃OS. The IUPAC name of this chemical is 1-amino-3-(furan-2-ylmethyl)thiourea. With the CAS registry number 96860-19-4, it is also named as N-(2-Furylmethyl)hydrazinecarbothioamide.

Physical properties about Hydrazinecarbothioamide,N-(2-furanylmethyl)- are: (1)ACD/LogP: 0.12; (2)ACD/LogD (pH 5.5): 0.12; (3)ACD/LogD (pH 7.4): 0.12; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 27.62; (7)ACD/KOC (pH 7.4): 27.55; (8)#H bond acceptors: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 54.95 Å²; (12)Index of Refraction: 1.619; (13)Molar Refractivity: 46.11 cm³; (14)Molar Volume: 131.3 cm³; (15)Polarizability: 18.28×10^-24cm³; (16)Surface Tension: 62.5 dyne/cm; (17)Density: 1.303 g/cm³; (18)Flash Point: 133.4 °C; (19)Enthalpy of Vaporization: 53.67 kJ/mol; (20)Boiling Point: 296.9 °C at 760 mmHg; (21)Vapour Pressure: 0.0014 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: S=C(NCc1occc1)NN
(2)InChI: InChI=1/C6H9N3OS/c7-9-6(11)8-4-5-2-1-3-10-5/h1-3H,4,7H2,(H2,8,9,11)
(3)InChIKey: SUKUNUQYDORCFO-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C6H9N3OS/c7-9-6(11)8-4-5-2-1-3-10-5/h1-3H,4,7H2,(H2,8,9,11)
(5)Std. InChIKey: SUKUNUQYDORCFO-UHFFFAOYSA-N