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1559-88-2 | Benzene, 3-bromo-1,2,4,5-tetrafluoro-
CAS No: 1559-88-2 Catalog No: AG001OBP MDL No:MFCD00000308
Product Description
Catalog Number:
AG001OBP
Chemical Name:
Benzene, 3-bromo-1,2,4,5-tetrafluoro-
CAS Number:
1559-88-2
Molecular Formula:
C6HBrF4
Molecular Weight:
228.9698
MDL Number:
MFCD00000308
IUPAC Name:
3-bromo-1,2,4,5-tetrafluorobenzene
InChI:
InChI=1S/C6HBrF4/c7-4-5(10)2(8)1-3(9)6(4)11/h1H
InChI Key:
YHAFCGSUIAFUCX-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c(c(c1F)Br)F
EC Number:
216-327-9
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.92g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.972g/mol
Monoisotopic Mass:
227.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
| Title | Journal |
|---|---|
| 1-Bromo-2,3,5,6-tetra-fluoro-4-nitro-benzene. | Acta crystallographica. Section E, Structure reports online 20110701 |
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