Carbamodithioic acid,ethyl ester supplier

Name
ethylsulfanylmethanethioamide
EINECS
CAS No. 625-61-6
Article Data6
CAS DataBase
Density 1.203 g/cm³
Solubility
Melting Point
Formula C₃H₇NS₂
Boiling Point 199.2 °C at 760 mmHg
Molecular Weight 121.227
Flash Point 74.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Carbamicacid, dithio-, ethyl ester (6CI,8CI);Ethyl carbamodithioate;Ethyldithiocarbamate;NSC 25948;
PSA 83.41000
LogP 1.68340

Carbamodithioic acid,ethyl ester Specification

The Carbamodithioic acid,ethyl ester, with the CAS registry number 625-61-6, is also known as Ethyldithiocarbamate. This chemical's molecular formula is C₃H₇NS₂ and molecular weight is 121.22. What's more, its IUPAC name is ethyl carbamodithioate.

Physical properties of Carbamodithioic acid,ethyl ester are: (1)ACD/LogP: 1.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.1; (4)ACD/LogD (pH 7.4): 1.1; (5)ACD/BCF (pH 5.5): 4.05; (6)ACD/BCF (pH 7.4): 4.05; (7)ACD/KOC (pH 5.5): 94.69; (8)ACD/KOC (pH 7.4): 94.7; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 60.63 Å²; (13)Index of Refraction: 1.606; (14)Molar Refractivity: 34.76 cm³; (15)Molar Volume: 100.6 cm³; (16)Polarizability: 13.78×10^-24cm³; (17)Surface Tension: 57.8 dyne/cm; (18)Density: 1.203 g/cm³; (19)Flash Point: 74.3 °C; (20)Enthalpy of Vaporization: 43.54 kJ/mol; (21)Boiling Point: 199.2 °C at 760 mmHg; (22)Vapour Pressure: 0.346 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCSC(=S)N
(2)InChI: InChI=1S/C3H7NS2/c1-2-6-3(4)5/h2H2,1H3,(H2,4,5)
(3)InChIKey: PBRXDWOPIKZYOJ-UHFFFAOYSA-N

Product Name

ethylsulfanylmethanethioamide

Carbamodithioic acid,ethyl ester Specification

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