1,3-Benzodioxole-5-carboxylicacid, 7-bromo-


Chemical Name: 1,3-Benzodioxole-5-carboxylicacid, 7-bromo-
CAS Number: 66799-93-7
Product Number: AG003NDT(AGN-PC-0LGGL9)
Synonyms:
MDL No: MFCD06496489
Molecular Formula: C8H5BrO4
Molecular Weight: 245.0269

Identification/Properties


Properties
BP:
373.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
245.028g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
243.937g/mol
Monoisotopic Mass:
243.937g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
220
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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