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1824263-24-2

1824263-24-2 | 2-(1-methyl-1H-imidazol-2-yl)ethanethioamide

CAS No: 1824263-24-2 Catalog No: AG01BHLZ MDL No:MFCD28145313

Product Description

Catalog Number:
AG01BHLZ
Chemical Name:
2-(1-methyl-1H-imidazol-2-yl)ethanethioamide
CAS Number:
1824263-24-2
Molecular Formula:
C6H9N3S
Molecular Weight:
155.2208
MDL Number:
MFCD28145313
IUPAC Name:
2-(1-methylimidazol-2-yl)ethanethioamide
InChI:
InChI=1S/C6H9N3S/c1-9-3-2-8-6(9)4-5(7)10/h2-3H,4H2,1H3,(H2,7,10)
InChI Key:
QTRUXVUMXGCDCD-UHFFFAOYSA-N
SMILES:
NC(=S)Cc1nccn1C

Properties

Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.052g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
155.219g/mol
Monoisotopic Mass:
155.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  

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