4-(2,5-DIOXO-2,5-DIHYDRO-PYRROL-1-YL)-PHTHALIC ACID


Chemical Name: 4-(2,5-DIOXO-2,5-DIHYDRO-PYRROL-1-YL)-PHTHALIC ACID
CAS Number: 56896-91-4
Product Number: AG00ED9I(AGN-PC-0K6CY7)
Synonyms:
MDL No:
Molecular Formula: C12H7NO6
Molecular Weight: 261.1871

Identification/Properties


Properties
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
261.189g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
261.027g/mol
Monoisotopic Mass:
261.027g/mol
Topological Polar Surface Area:
112A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
465
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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