4-Oxazolecarboxylicacid, 2-(1,3-benzodioxol-5-yl)-


Chemical Name: 4-Oxazolecarboxylicacid, 2-(1,3-benzodioxol-5-yl)-
CAS Number: 885273-88-1
Product Number: AG0089GZ(AGN-PC-01RHQ7)
Synonyms:
MDL No:
Molecular Formula: C11H7NO5
Molecular Weight: 233.1770

Identification/Properties


Computed Properties
Molecular Weight:
233.179g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
233.032g/mol
Monoisotopic Mass:
233.032g/mol
Topological Polar Surface Area:
81.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
310
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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