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782441-82-1 | 1H-Imidazole-1-carbodithioicacid, 2,5-dihydro-
CAS No: 782441-82-1 Catalog No: AG008N7I MDL No:
Product Description
Catalog Number:
AG008N7I
Chemical Name:
1H-Imidazole-1-carbodithioicacid, 2,5-dihydro-
CAS Number:
782441-82-1
Molecular Formula:
C4H6N2S2
Molecular Weight:
146.2338
IUPAC Name:
2,4-dihydroimidazole-3-carbodithioic acid
InChI:
InChI=1S/C4H6N2S2/c7-4(8)6-2-1-5-3-6/h1H,2-3H2,(H,7,8)
InChI Key:
WQWZWMKHTIMZAR-UHFFFAOYSA-N
SMILES:
SC(=S)N1CN=CC1
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.997g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.226g/mol
Monoisotopic Mass:
145.997g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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