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1996-29-8 | Benzene, 1-bromo-4-chloro-2-fluoro-
CAS No: 1996-29-8 Catalog No: AG002C80 MDL No:MFCD00079708
Product Description
Catalog Number:
AG002C80
Chemical Name:
Benzene, 1-bromo-4-chloro-2-fluoro-
CAS Number:
1996-29-8
Molecular Formula:
C6H3BrClF
Molecular Weight:
209.4434
MDL Number:
MFCD00079708
IUPAC Name:
1-bromo-4-chloro-2-fluorobenzene
InChI:
InChI=1S/C6H3BrClF/c7-5-2-1-4(8)3-6(5)9/h1-3H
InChI Key:
FPNVMCMDWZNTEU-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)F)Br
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.909g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.442g/mol
Monoisotopic Mass:
207.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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