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Home > Imidazoles > 820964-12-3
820964-12-3 | 1H-Pyrrolo[1,2-c]imidazol-1-one, 2,3-dihydro-2-(1-methylethyl)-3-thioxo-
CAS No: 820964-12-3 Catalog No: AG005C3P MDL No:
Product Description
Catalog Number:
AG005C3P
Chemical Name:
1H-Pyrrolo[1,2-c]imidazol-1-one, 2,3-dihydro-2-(1-methylethyl)-3-thioxo-
CAS Number:
820964-12-3
Molecular Formula:
C9H10N2OS
Molecular Weight:
194.2535
IUPAC Name:
2-propan-2-yl-3-sulfanylidenepyrrolo[1,2-c]imidazol-1-one
InChI:
InChI=1S/C9H10N2OS/c1-6(2)11-8(12)7-4-3-5-10(7)9(11)13/h3-6H,1-2H3
InChI Key:
CIPLFMDSVMZBIT-UHFFFAOYSA-N
SMILES:
CC(n1c(=S)n2c(c1=O)ccc2)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.252g/mol
Monoisotopic Mass:
194.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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