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351003-21-9 | 2-Bromo-4-fluorobenzotrifluoride
CAS No: 351003-21-9 Catalog No: AG003GO9 MDL No:MFCD03094041
Product Description
Catalog Number:
AG003GO9
Chemical Name:
2-Bromo-4-fluorobenzotrifluoride
CAS Number:
351003-21-9
Molecular Formula:
C7H3BrF4
Molecular Weight:
242.9963
MDL Number:
MFCD03094041
IUPAC Name:
2-bromo-4-fluoro-1-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H3BrF4/c8-6-3-4(9)1-2-5(6)7(10,11)12/h1-3H
InChI Key:
XBBGYSIEJHXPLL-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Br)C(F)(F)F
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.935g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.999g/mol
Monoisotopic Mass:
241.935g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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