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400077-37-4 | 3,4-Isoxazoledicarboxamide,5-methyl-(9CI)
CAS No: 400077-37-4 Catalog No: AG00CZ4E MDL No:
Product Description
Catalog Number:
AG00CZ4E
Chemical Name:
3,4-Isoxazoledicarboxamide,5-methyl-(9CI)
CAS Number:
400077-37-4
IUPAC Name:
5-methyl-1,2-oxazole-3,4-dicarboxamide
InChI:
InChI=1S/C6H7N3O3/c1-2-3(5(7)10)4(6(8)11)9-12-2/h1H3,(H2,7,10)(H2,8,11)
InChI Key:
BNPNRCBWTDXXLP-UHFFFAOYSA-N
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.049g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
169.14g/mol
Monoisotopic Mass:
169.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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