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151411-98-2 | Benzene, 2-(bromomethyl)-1,3,5-trifluoro-
CAS No: 151411-98-2 Catalog No: AG001NB9 MDL No:MFCD00061210
Product Description
Catalog Number:
AG001NB9
Chemical Name:
Benzene, 2-(bromomethyl)-1,3,5-trifluoro-
CAS Number:
151411-98-2
Molecular Formula:
C7H4BrF3
Molecular Weight:
225.0059
MDL Number:
MFCD00061210
IUPAC Name:
2-(bromomethyl)-1,3,5-trifluorobenzene
InChI:
InChI=1S/C7H4BrF3/c8-3-5-6(10)1-4(9)2-7(5)11/h1-2H,3H2
InChI Key:
SPPLWANVCVTGEQ-UHFFFAOYSA-N
SMILES:
BrCc1c(F)cc(cc1F)F
Properties
Complexity:
119
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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