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79009-27-1

79009-27-1 | Ethanethioamide, N-[(methylamino)thioxomethyl]-

CAS No: 79009-27-1 Catalog No: AG005CDK MDL No:

Product Description

Catalog Number:
AG005CDK
Chemical Name:
Ethanethioamide, N-[(methylamino)thioxomethyl]-
CAS Number:
79009-27-1
Molecular Formula:
C4H8N2S2
Molecular Weight:
148.2497
IUPAC Name:
N-(methylcarbamothioyl)ethanethioamide
InChI:
InChI=1S/C4H8N2S2/c1-3(7)6-4(8)5-2/h1-2H3,(H2,5,6,7,8)
InChI Key:
YQTKBLUHRBWZGU-UHFFFAOYSA-N
SMILES:
CNC(=S)NC(=S)C

Properties

Complexity:
111  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.013g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
148.242g/mol
Monoisotopic Mass:
148.013g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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