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Home > Imidazoles > 91121-80-1
91121-80-1 | 4-Imidazolidinone, 5-(2-methylpropylidene)-2-thioxo-
CAS No: 91121-80-1 Catalog No: AG006QSN MDL No:
Product Description
Catalog Number:
AG006QSN
Chemical Name:
4-Imidazolidinone, 5-(2-methylpropylidene)-2-thioxo-
CAS Number:
91121-80-1
Molecular Formula:
C7H10N2OS
Molecular Weight:
170.2321
IUPAC Name:
5-(2-methylpropylidene)-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C7H10N2OS/c1-4(2)3-5-6(10)9-7(11)8-5/h3-4H,1-2H3,(H2,8,9,10,11)
InChI Key:
WSMRNAPSUJKNOL-UHFFFAOYSA-N
SMILES:
CC(C=C1NC(=S)NC1=O)C
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.051g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
170.23g/mol
Monoisotopic Mass:
170.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.2
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