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Home > Bromides > 1160573-27-2
1160573-27-2 | 4-Bromo-2,5-dichloro-6-fluorobenzoic acid
CAS No: 1160573-27-2 Catalog No: AG01FBGV MDL No:MFCD11845997
Product Description
Catalog Number:
AG01FBGV
Chemical Name:
4-Bromo-2,5-dichloro-6-fluorobenzoic acid
CAS Number:
1160573-27-2
Molecular Formula:
C7H2BrCl2FO2
Molecular Weight:
287.8980
MDL Number:
MFCD11845997
IUPAC Name:
4-bromo-3,6-dichloro-2-fluorobenzoic acid
InChI:
InChI=1S/C7H2BrCl2FO2/c8-2-1-3(9)4(7(12)13)6(11)5(2)10/h1H,(H,12,13)
InChI Key:
NABZUAHIFQFLAU-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(Cl)cc(c(c1F)Cl)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:
285.86g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.893g/mol
Monoisotopic Mass:
285.86g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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