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85117-99-3 | 2-(Bromomethyl)-1,4-difluorobenzene
CAS No: 85117-99-3 Catalog No: AG003FYF MDL No:MFCD00009897
Product Description
Catalog Number:
AG003FYF
Chemical Name:
2-(Bromomethyl)-1,4-difluorobenzene
CAS Number:
85117-99-3
Molecular Formula:
C7H5BrF2
Molecular Weight:
207.0154
MDL Number:
MFCD00009897
IUPAC Name:
2-(bromomethyl)-1,4-difluorobenzene
InChI:
InChI=1S/C7H5BrF2/c8-4-5-3-6(9)1-2-7(5)10/h1-3H,4H2
InChI Key:
ONWGSWNHQZYCFK-UHFFFAOYSA-N
SMILES:
BrCc1cc(F)ccc1F
EC Number:
285-651-0
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.954g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.018g/mol
Monoisotopic Mass:
205.954g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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