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115491-90-2

115491-90-2 | 1,2,4-Oxadiazolidine-3,5-dione, 2,2'-carbonylbis[4-methyl- (9CI)

CAS No: 115491-90-2 Catalog No: AG000G2J MDL No:MFCD00191328

Product Description

Catalog Number:
AG000G2J
Chemical Name:
1,2,4-Oxadiazolidine-3,5-dione, 2,2'-carbonylbis[4-methyl- (9CI)
CAS Number:
115491-90-2
Molecular Formula:
C7H6N4O7
Molecular Weight:
258.1451
MDL Number:
MFCD00191328
IUPAC Name:
4-methyl-2-(4-methyl-3,5-dioxo-1,2,4-oxadiazolidine-2-carbonyl)-1,2,4-oxadiazolidine-3,5-dione
InChI:
InChI=1S/C7H6N4O7/c1-8-3(12)10(17-6(8)15)5(14)11-4(13)9(2)7(16)18-11/h1-2H3
InChI Key:
IOMAUIUYBQXXKP-UHFFFAOYSA-N
SMILES:
O=C(n1oc(=O)n(c1=O)C)n1oc(=O)n(c1=O)C

Properties

Complexity:
446  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.024g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.146g/mol
Monoisotopic Mass:
258.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

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