1,2-Dithiolane-4-carboxamide,4-methyl- supplier

Name
1,2-Dithiolane-4-carboxamide,4-methyl-(9CI)
EINECS
CAS No. 208243-73-6
Article Data3
CAS DataBase
Density 1.311 g/cm³
Solubility
Melting Point
Formula C₅H₉NOS₂
Boiling Point 350.8 °C at 760 mmHg
Molecular Weight 163.265
Flash Point 165.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,2-Dithiolane-4-carboxamide,4-methyl-(9CI);1,2-Dithiolane-4-carboxamide, 4-methyl-;2-Dithiolane-4-carboxaMide;4-Carbamoyl-4-methyl-1,2-dithiolane, 4-(Aminocarbonyl)-4-methyl-1,2-dithiolane
PSA 93.69000
LogP 1.57330

1,2-Dithiolane-4-carboxamide,4-methyl- Specification

This chemical is called 1,2-Dithiolane-4-carboxamide,4-methyl-, and its systematic name is 4-methyldithiolane-4-carboxamide. With the molecular formula of C₅H₉NOS₂, its molecular weight is 163.2611. The CAS registry number of this chemical is . Additionally, its product category is Amide.

Other characteristics of the 1,2-Dithiolane-4-carboxamide,4-methyl- can be summarised as followings: (1)ACD/LogP: 0.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.57; (4)ACD/LogD (pH 7.4): 0.57; (5)#H bond acceptors: 2; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 93.69 Å²; (9)Index of Refraction: 1.604; (10)Molar Refractivity: 42.88 cm³; (11)Molar Volume: 124.5 cm³; (12)Polarizability: 16.99×10^-24cm³; (13)Surface Tension: 53.4 dyne/cm; (14)Density: 1.311 g/cm³; (15)Flash Point: 165.9 °C; (16)Enthalpy of Vaporization: 59.54 kJ/mol; (17)Boiling Point: 350.8 °C at 760 mmHg; (18)Vapour Pressure: 4.3E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: CC1(CSSC1)C(=O)N
2.InChI: InChI=1/C5H9NOS2/c1-5(4(6)7)2-8-9-3-5/h2-3H2,1H3,(H2,6,7)
3.InChIKey: GUZRHBSIAMFARD-UHFFFAOYAC

Product Name

1,2-Dithiolane-4-carboxamide,4-methyl-(9CI)

1,2-Dithiolane-4-carboxamide,4-methyl- Specification

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