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15033-52-0 | Ethanone, 1-(2,3-dihydro-3-methyl-2-thioxo-1H-imidazol-1-yl)-
CAS No: 15033-52-0 Catalog No: AG001MIZ MDL No:
Product Description
Catalog Number:
AG001MIZ
Chemical Name:
Ethanone, 1-(2,3-dihydro-3-methyl-2-thioxo-1H-imidazol-1-yl)-
CAS Number:
15033-52-0
Molecular Formula:
C6H8N2OS
Molecular Weight:
156.2055
IUPAC Name:
1-(3-methyl-2-sulfanylideneimidazol-1-yl)ethanone
InChI:
InChI=1S/C6H8N2OS/c1-5(9)8-4-3-7(2)6(8)10/h3-4H,1-2H3
InChI Key:
DTFWFMVDNHVQFI-UHFFFAOYSA-N
SMILES:
Cn1ccn(c1=S)C(=O)C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.036g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.203g/mol
Monoisotopic Mass:
156.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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