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38955-11-2 | 3-Methylisoxazole-5-carboxaMide
CAS No: 38955-11-2 Catalog No: AG00CMGE MDL No:
Product Description
Catalog Number:
AG00CMGE
Chemical Name:
3-Methylisoxazole-5-carboxaMide
CAS Number:
38955-11-2
IUPAC Name:
3-methyl-1,2-oxazole-5-carboxamide
InChI:
InChI=1S/C5H6N2O2/c1-3-2-4(5(6)8)9-7-3/h2H,1H3,(H2,6,8)
InChI Key:
MMHCFPWSEIVWCD-UHFFFAOYSA-N
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.115g/mol
Monoisotopic Mass:
126.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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