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N,N-Dimethylthioacetamide

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Name

N,N-Dimethylthioacetamide

EINECS N/A
CAS No. 631-67-4 Density 0.966
PSA 35.33000 LogP 0.89530
Solubility N/A Melting Point 71-73°C
Formula C4H9 N S Boiling Point 125-127°C 22mm
Molecular Weight 103.188 Flash Point 125-127°C/22mm
Transport Information N/A Appearance N/A
Safety Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and SOx. Risk Codes 36/37/38
Molecular Structure Molecular Structure of 631-67-4 (N,N-DIMETHYLTHIOACETAMIDE) Hazard Symbols N/A
Synonyms

Acetamide,N,N-dimethylthio- (6CI,7CI,8CI); Dimethylthioacetamide;N,N-Dimethylthioacetamide

Article Data 30

N,N-Dimethylthioacetamide Chemical Properties

Molecule structure of N,N-Dimethylthioacetamide (CAS NO.631-67-4):

IUPAC Name: N,N-Dimethylethanethioamide 
Molecular Weight: 103.18596 g/mol
Molecular Formula: C4H9NS 
Density: 0.966 g/cm3 
Melting Point: 71-73 °C
Boiling Point: 104.4 °C at 760 mmHg 
Flash Point: 17 °C
Index of Refraction: 1.503
Molar Refractivity: 31.59 cm3
Molar Volume: 106.8 cm3
Polarizability: 12.52×10-24 cm3
Surface Tension: 37 dyne/cm 
Enthalpy of Vaporization: 34.35 kJ/mol
Vapour Pressure: 30.8 mmHg at 25 °C
XLogP3-AA: 0.3
Exact Mass: 103.04557
MonoIsotopic Mass: 103.04557
Topological Polar Surface Area: 3.2
Heavy Atom Count: 6
Complexity: 58.6
Canonical SMILES: CC(=S)N(C)C
InChI: InChI=1S/C4H9NS/c1-4(6)5(2)3/h1-3H3
InChIKey: LKNQXZAHNDFIQY-UHFFFAOYSA-N

N,N-Dimethylthioacetamide Toxicity Data With Reference

1.    

ipr-mus LD50:500 mg/kg

    AEPPAE    Naunyn-Schmiedebergs Archiv fuer Experimentelle Pathologie und Pharmakologie. 233 (1958),376.

N,N-Dimethylthioacetamide Consensus Reports

Reported in EPA TSCA Inventory.

N,N-Dimethylthioacetamide Safety Profile

Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx and SOx.

N,N-Dimethylthioacetamide Specification

 N,N-Dimethylthioacetamide (CAS NO.631-67-4) is also named as 4-04-00-00182 (Beilstein Handbook Reference) ; BRN 1737685 ; Dimethylthioacetamid ; Dimethylthioacetamid [German] ; Dimethylthioacetamide ; N,N-Dimethylethanethioamide ;
Acetamide, N,N-dimethylthio- ; Ethanethioamide, N,N-dimethyl- .

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