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1λ6-1H-Thiophene-1,1-diimine,tetrahydro-

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Name

1λ6-1H-Thiophene-1,1-diimine,tetrahydro-

EINECS N/A
CAS No. 53245-06-0 Density 1.35 g/cm3
PSA 56.08000 LogP 2.30900
Solubility N/A Melting Point N/A
Formula C4H10N2S Boiling Point 158.4 °C at 760 mmHg
Molecular Weight 118.203 Flash Point 49.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 53245-06-0 (TETRAHYDROTHIOPHENE-1,1-DIYLIDENEDIAMINE) Hazard Symbols N/A
Synonyms

Tetrahydrothiophene-1,1-diylidenediamine;

 

1λ6-1H-Thiophene-1,1-diimine,tetrahydro- Specification

The 1λ6-1H-Thiophene-1,1-diimine,tetrahydro-, with the CAS registry number 53245-06-0, is also known as Tetrahydrothiophene-1,1-diylidenediamine. This chemical's molecular formula is C4H10N2S and molecular weight is 118.2006. What's more, its systematic name is called Tetrahydro-1H-1λ6-thiophene-1,1-diimine.

Physical properties about 1λ6-1H-Thiophene-1,1-diimine,tetrahydro- are: (1)#of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 6.39; (5)ACD/KOC (pH 7.4): 6.39; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 0; (9)Polar Surface Area: 56.08 Å2; (10)Index of Refraction: 1.611; (11)Molar Refractivity: 30.3 cm3; (12)Molar Volume: 87.2 cm3; (13)Polarizability: 12.01×10-24 cm3 ; (14)Surface Tension: 55.5 dyne/cm; (15)Density: 1.35 g/cm3; (16)Flash Point: 49.6 °C; (17)Enthalpy of Vaporization: 37.88 kJ/mol; (18)Boiling Point: 158.4 °C at 760 mmHg; (19)Vapour Pressure: 3.41 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: N=S1(=N)CCCC1
(2) InChI: InChI=1/C4H10N2S/c5-7(6)3-1-2-4-7/h5-6H,1-4H2
(3) InChIKey: PTUHOPHIOKTEGM-UHFFFAOYAD

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