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Home > Imidazoles > 2060057-22-7
2060057-22-7 | ethyl(imino)(1-methyl-1H-imidazol-2-yl)-lambda6-sulfanone
CAS No: 2060057-22-7 Catalog No: AG01BVCO MDL No:MFCD30345467
Product Description
Catalog Number:
AG01BVCO
Chemical Name:
ethyl(imino)(1-methyl-1H-imidazol-2-yl)-lambda6-sulfanone
CAS Number:
2060057-22-7
Molecular Formula:
C6H11N3OS
Molecular Weight:
173.2360
MDL Number:
MFCD30345467
IUPAC Name:
ethyl-imino-(1-methylimidazol-2-yl)-oxo-λ6-sulfane
InChI:
InChI=1S/C6H11N3OS/c1-3-11(7,10)6-8-4-5-9(6)2/h4-5,7H,3H2,1-2H3
InChI Key:
XYTZESBCXAPXQB-UHFFFAOYSA-N
SMILES:
CCS(=O)(=N)c1nccn1C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.062g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.234g/mol
Monoisotopic Mass:
173.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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