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Home > Imidazoles > 143122-18-3
143122-18-3 | 2H-Imidazole-2-thione,1,3-dihydro-5-(hydroxymethyl)-1-methyl-
CAS No: 143122-18-3 Catalog No: AG007Z42 MDL No:MFCD11109389
Product Description
Catalog Number:
AG007Z42
Chemical Name:
2H-Imidazole-2-thione,1,3-dihydro-5-(hydroxymethyl)-1-methyl-
CAS Number:
143122-18-3
Molecular Formula:
C5H8N2OS
Molecular Weight:
144.1948
MDL Number:
MFCD11109389
IUPAC Name:
4-(hydroxymethyl)-3-methyl-1H-imidazole-2-thione
InChI:
InChI=1S/C5H8N2OS/c1-7-4(3-8)2-6-5(7)9/h2,8H,3H2,1H3,(H,6,9)
InChI Key:
GXYFRGKYSBWAEO-UHFFFAOYSA-N
SMILES:
Cn1cc(nc1S)CO
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.036g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
144.192g/mol
Monoisotopic Mass:
144.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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