Home Carboxys 2-methyl-5,5-dioxo-2H,4H,6H,7H-5lambda6-thiopyrano[4,3-c]pyrazole-3-carboxylic acid

2-methyl-5,5-dioxo-2H,4H,6H,7H-5lambda6-thiopyrano[4,3-c]pyrazole-3-carboxylic acid

CAS No.:
1368299-92-6
Catalog Number:
AG01BIFS
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01BIFS
Chemical Name:
2-methyl-5,5-dioxo-2H,4H,6H,7H-5lambda6-thiopyrano[4,3-c]pyrazole-3-carboxylic acid
CAS Number:
1368299-92-6
MDL Number:
MFCD22035356
IUPAC Name:
2-methyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[4,3-c]pyrazole-3-carboxylic acid
InChI:
InChI=1S/C8H10N2O4S/c1-10-7(8(11)12)5-4-15(13,14)3-2-6(5)9-10/h2-4H2,1H3,(H,11,12)
InChI Key:
LAUVWIDHDKYTDQ-UHFFFAOYSA-N
Properties
Complexity:
375  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.036g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.238g/mol
Monoisotopic Mass:
230.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties