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648427-45-6

648427-45-6 | 1H-Imidazole-1-ethanethioamide(9CI)

CAS No: 648427-45-6 Catalog No: AG00EX7O MDL No:

Product Description

Catalog Number:
AG00EX7O
Chemical Name:
1H-Imidazole-1-ethanethioamide(9CI)
CAS Number:
648427-45-6
IUPAC Name:
2-imidazol-1-ylethanethioamide
InChI:
InChI=1S/C5H7N3S/c6-5(9)3-8-2-1-7-4-8/h1-2,4H,3H2,(H2,6,9)
InChI Key:
JJVGMDHGOBFPSO-UHFFFAOYSA-N

Properties

Complexity:
115  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.036g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.192g/mol
Monoisotopic Mass:
141.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  

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