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157911-55-2 | Benzene, 1-(bromomethyl)-2,3,4-trifluoro-
CAS No: 157911-55-2 Catalog No: AG001PT2 MDL No:MFCD00061233
Product Description
Catalog Number:
AG001PT2
Chemical Name:
Benzene, 1-(bromomethyl)-2,3,4-trifluoro-
CAS Number:
157911-55-2
Molecular Formula:
C7H4BrF3
Molecular Weight:
225.0059
MDL Number:
MFCD00061233
IUPAC Name:
1-(bromomethyl)-2,3,4-trifluorobenzene
InChI:
InChI=1S/C7H4BrF3/c8-3-4-1-2-5(9)7(11)6(4)10/h1-2H,3H2
InChI Key:
DGSXDQVPGXFOAN-UHFFFAOYSA-N
SMILES:
BrCc1ccc(c(c1F)F)F
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.945g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.008g/mol
Monoisotopic Mass:
223.945g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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