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Home > Imidazoles > 98412-27-2
98412-27-2 | 2H-Imidazole-2-thione, 1-ethyl-1,3-dihydro-5-(hydroxymethyl)-
CAS No: 98412-27-2 Catalog No: AG019SXX MDL No:MFCD09743113
Product Description
Catalog Number:
AG019SXX
Chemical Name:
2H-Imidazole-2-thione, 1-ethyl-1,3-dihydro-5-(hydroxymethyl)-
CAS Number:
98412-27-2
MDL Number:
MFCD09743113
IUPAC Name:
3-ethyl-4-(hydroxymethyl)-1H-imidazole-2-thione
InChI:
InChI=1S/C6H10N2OS/c1-2-8-5(4-9)3-7-6(8)10/h3,9H,2,4H2,1H3,(H,7,10)
InChI Key:
JRGDGGYXZKWDFN-UHFFFAOYSA-N
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.051g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
158.219g/mol
Monoisotopic Mass:
158.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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