1,3-Benzodioxole-5-carboxylic acid, 2,2-difluoro-, methyl ester


Chemical Name: 1,3-Benzodioxole-5-carboxylic acid, 2,2-difluoro-, methyl ester
CAS Number: 773873-95-3
Product Number: AG005BKE(AGN-PC-0CR8UT)
Synonyms:
MDL No:
Molecular Formula: C9H6F2O4
Molecular Weight: 216.1383

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
216.14g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
216.023g/mol
Monoisotopic Mass:
216.023g/mol
Topological Polar Surface Area:
44.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
269
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


NMR Spectrum


Other Analytical Data


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