Home Carboxys 3,6-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazine-4-carboxylic acid

3,6-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazine-4-carboxylic acid

CAS No.:
1249969-05-8
Catalog Number:
AG01A8ZF
Molecular Formula:
C8H7N3O4
Molecular Weight:
209.1589
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Product Description
Catalog Number:
AG01A8ZF
Chemical Name:
3,6-dimethyl-7-oxo-6H,7H-[1,2]oxazolo[3,4-d]pyridazine-4-carboxylic acid
CAS Number:
1249969-05-8
Molecular Formula:
C8H7N3O4
Molecular Weight:
209.1589
MDL Number:
MFCD16817405
IUPAC Name:
3,6-dimethyl-7-oxo-[1,2]oxazolo[3,4-d]pyridazine-4-carboxylic acid
InChI:
InChI=1S/C8H7N3O4/c1-3-4-5(10-15-3)7(12)11(2)9-6(4)8(13)14/h1-2H3,(H,13,14)
InChI Key:
UHFARKFCJJQCPF-UHFFFAOYSA-N
SMILES:
OC(=O)c1nn(C)c(=O)c2c1c(C)on2
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.044g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.161g/mol
Monoisotopic Mass:
209.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties