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601-84-3 | 2,6-Dibromobenzoic acid
CAS No: 601-84-3 Catalog No: AG003310 MDL No:MFCD00234254
Product Description
Catalog Number:
AG003310
Chemical Name:
2,6-Dibromobenzoic acid
CAS Number:
601-84-3
Molecular Formula:
C7H4Br2O2
Molecular Weight:
279.9135
MDL Number:
MFCD00234254
IUPAC Name:
2,6-dibromobenzoic acid
InChI:
InChI=1S/C7H4Br2O2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11)
InChI Key:
HQLOEBRPCVIFCT-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(Br)cccc1Br
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.856g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.915g/mol
Monoisotopic Mass:
277.858g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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