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Home > Bromides > 1160573-60-3
1160573-60-3 | 2,4-Dibromo-3,6-difluorobenzoic acid
CAS No: 1160573-60-3 Catalog No: AG01FDBL MDL No:MFCD11845987
Product Description
Catalog Number:
AG01FDBL
Chemical Name:
2,4-Dibromo-3,6-difluorobenzoic acid
CAS Number:
1160573-60-3
Molecular Formula:
C7H2Br2F2O2
Molecular Weight:
315.8944
MDL Number:
MFCD11845987
IUPAC Name:
2,4-dibromo-3,6-difluorobenzoic acid
InChI:
InChI=1S/C7H2Br2F2O2/c8-2-1-3(10)4(7(12)13)5(9)6(2)11/h1H,(H,12,13)
InChI Key:
NWYHWZSLBBJJMR-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(F)cc(c(c1Br)F)Br
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.837g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.896g/mol
Monoisotopic Mass:
313.839g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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