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Home > Imidazoles > 90173-92-5
90173-92-5 | 1H-Imidazole-5-carbodithioic acid, 1-(2-hydroxyethyl)-
CAS No: 90173-92-5 Catalog No: AG00H64N MDL No:
Product Description
Catalog Number:
AG00H64N
Chemical Name:
1H-Imidazole-5-carbodithioic acid, 1-(2-hydroxyethyl)-
CAS Number:
90173-92-5
Molecular Formula:
C6H8N2OS2
Molecular Weight:
188.2705
IUPAC Name:
3-(2-hydroxyethyl)imidazole-4-carbodithioic acid
InChI:
InChI=1S/C6H8N2OS2/c9-2-1-8-4-7-3-5(8)6(10)11/h3-4,9H,1-2H2,(H,10,11)
InChI Key:
RVPFGOWEPLNTIR-UHFFFAOYSA-N
SMILES:
OCCn1cncc1C(=S)S
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.008g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.263g/mol
Monoisotopic Mass:
188.008g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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