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Home > Imidazoles > 956726-60-6
956726-60-6 | 5-methyl-5-[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]imidazolidine-2,4-dione
CAS No: 956726-60-6 Catalog No: AG019ORX MDL No:MFCD07366454
Product Description
Catalog Number:
AG019ORX
Chemical Name:
5-methyl-5-[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]imidazolidine-2,4-dione
CAS Number:
956726-60-6
Molecular Formula:
C11H10N6O2
Molecular Weight:
258.2361
MDL Number:
MFCD07366454
IUPAC Name:
5-methyl-5-[3-(tetrazol-1-yl)phenyl]imidazolidine-2,4-dione
InChI:
InChI=1S/C11H10N6O2/c1-11(9(18)13-10(19)14-11)7-3-2-4-8(5-7)17-6-12-15-16-17/h2-6H,1H3,(H2,13,14,18,19)
InChI Key:
UERGTDHREWSFSJ-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(N1)(C)c1cccc(c1)n1cnnn1
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.087g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.241g/mol
Monoisotopic Mass:
258.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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