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1289007-84-6 | 2-Bromo-5-formylbenzoic acid
CAS No: 1289007-84-6 Catalog No: AG01FH8Q MDL No:
Product Description
Catalog Number:
AG01FH8Q
Chemical Name:
2-Bromo-5-formylbenzoic acid
CAS Number:
1289007-84-6
IUPAC Name:
2-bromo-5-formylbenzoic acid
InChI:
InChI=1S/C8H5BrO3/c9-7-2-1-5(4-10)3-6(7)8(11)12/h1-4H,(H,11,12)
InChI Key:
KXPWKTRXWVQFGM-UHFFFAOYSA-N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.942g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.029g/mol
Monoisotopic Mass:
227.942g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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