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Home > Bromides > 1160573-47-6
1160573-47-6 | 3,5-Dibromo-2-fluoro-6-chlorobenzoic acid
CAS No: 1160573-47-6 Catalog No: AG01FBGZ MDL No:MFCD11845981
Product Description
Catalog Number:
AG01FBGZ
Chemical Name:
3,5-Dibromo-2-fluoro-6-chlorobenzoic acid
CAS Number:
1160573-47-6
Molecular Formula:
C7H2Br2ClFO2
Molecular Weight:
332.3490
MDL Number:
MFCD11845981
IUPAC Name:
3,5-dibromo-2-chloro-6-fluorobenzoic acid
InChI:
InChI=1S/C7H2Br2ClFO2/c8-2-1-3(9)6(11)4(5(2)10)7(12)13/h1H,(H,12,13)
InChI Key:
JOMGBIREKKYKBL-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(F)c(Br)cc(c1Cl)Br
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.807g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.347g/mol
Monoisotopic Mass:
329.809g/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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