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124815-04-9 | 4H-Pyrano[3,4-d]isoxazole-4,6(7H)-dione,3-methyl-(9CI)
CAS No: 124815-04-9 Catalog No: AG00AHN9 MDL No:
Product Description
Catalog Number:
AG00AHN9
Chemical Name:
4H-Pyrano[3,4-d]isoxazole-4,6(7H)-dione,3-methyl-(9CI)
CAS Number:
124815-04-9
IUPAC Name:
3-methyl-7H-pyrano[3,4-d][1,2]oxazole-4,6-dione
InChI:
InChI=1S/C7H5NO4/c1-3-6-4(12-8-3)2-5(9)11-7(6)10/h2H2,1H3
InChI Key:
IDHKFYCHZBZJIB-UHFFFAOYSA-N
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.022g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.12g/mol
Monoisotopic Mass:
167.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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