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Home > Imidazoles > 89224-45-3
89224-45-3 | 1,3-Imidazolidinedicarbothioamide, N,N'-diethyl-
CAS No: 89224-45-3 Catalog No: AG0044M2 MDL No:
Product Description
Catalog Number:
AG0044M2
Chemical Name:
1,3-Imidazolidinedicarbothioamide, N,N'-diethyl-
CAS Number:
89224-45-3
Molecular Formula:
C9H18N4S2
Molecular Weight:
246.3960
IUPAC Name:
1-N,3-N-diethylimidazolidine-1,3-dicarbothioamide
InChI:
InChI=1S/C9H18N4S2/c1-3-10-8(14)12-5-6-13(7-12)9(15)11-4-2/h3-7H2,1-2H3,(H,10,14)(H,11,15)
InChI Key:
KOFPWNLMNSECHA-UHFFFAOYSA-N
SMILES:
CCNC(=S)N1CCN(C1)C(=S)NCC
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.097g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
246.391g/mol
Monoisotopic Mass:
246.097g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
94.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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