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159329-06-3 | 6-Bromo-3-chloro-2-fluorobenzotrifluoride
CAS No: 159329-06-3 Catalog No: AG01FBPG MDL No:
Product Description
Catalog Number:
AG01FBPG
Chemical Name:
6-Bromo-3-chloro-2-fluorobenzotrifluoride
CAS Number:
159329-06-3
Molecular Formula:
C7H2BrClF4
Molecular Weight:
277.4414
IUPAC Name:
1-bromo-4-chloro-3-fluoro-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2BrClF4/c8-3-1-2-4(9)6(10)5(3)7(11,12)13/h1-2H
InChI Key:
AAKHIUDKITTXPN-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1C(F)(F)F)F)Cl
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.896g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.441g/mol
Monoisotopic Mass:
275.896g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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