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89663-07-0

89663-07-0 | Furo[3,4-c]pyridine-1,3-dione, 5-oxide

CAS No: 89663-07-0 Catalog No: AG0044WO MDL No:

Product Description

Catalog Number:
AG0044WO
Chemical Name:
Furo[3,4-c]pyridine-1,3-dione, 5-oxide
CAS Number:
89663-07-0
Molecular Formula:
C7H3NO4
Molecular Weight:
165.1030
IUPAC Name:
5-oxidofuro[3,4-c]pyridin-5-ium-1,3-dione
InChI:
InChI=1S/C7H3NO4/c9-6-4-1-2-8(11)3-5(4)7(10)12-6/h1-3H
InChI Key:
QNJZJZMZOFSMIN-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc2c(c1)C(=O)OC2=O

Properties

Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.006g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.104g/mol
Monoisotopic Mass:
165.006g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  

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