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Home > Imidazoles > 729553-52-0
729553-52-0 | 1H-Imidazole-1-ethanethioamide,2-methyl-(9CI)
CAS No: 729553-52-0 Catalog No: AG00FRN8 MDL No:
Product Description
Catalog Number:
AG00FRN8
Chemical Name:
1H-Imidazole-1-ethanethioamide,2-methyl-(9CI)
CAS Number:
729553-52-0
IUPAC Name:
2-(2-methylimidazol-1-yl)ethanethioamide
InChI:
InChI=1S/C6H9N3S/c1-5-8-2-3-9(5)4-6(7)10/h2-3H,4H2,1H3,(H2,7,10)
InChI Key:
SIANTBBDGGHTOV-UHFFFAOYSA-N
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:
0.1
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