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Home > Boronic Acids > 117695-55-3
117695-55-3 | 3,5-Dibromophenylboronic acid
CAS No: 117695-55-3 Catalog No: AG0077KM MDL No:MFCD01075725
Product Description
Catalog Number:
AG0077KM
Chemical Name:
3,5-Dibromophenylboronic acid
CAS Number:
117695-55-3
Molecular Formula:
C6H5BBr2O2
Molecular Weight:
279.7217
MDL Number:
MFCD01075725
IUPAC Name:
(3,5-dibromophenyl)boronic acid
InChI:
InChI=1S/C6H5BBr2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,10-11H
InChI Key:
WQBLCGDZYFKINX-UHFFFAOYSA-N
SMILES:
OB(c1cc(Br)cc(c1)Br)O
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.873g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
279.722g/mol
Monoisotopic Mass:
277.875g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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