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Home > Bromides > 1263178-51-3
1263178-51-3 | Benzene, 1-(bromomethyl)-3-(difluoromethyl)-
CAS No: 1263178-51-3 Catalog No: AG000SJD MDL No:MFCD18791600
Product Description
Catalog Number:
AG000SJD
Chemical Name:
Benzene, 1-(bromomethyl)-3-(difluoromethyl)-
CAS Number:
1263178-51-3
Molecular Formula:
C8H7BrF2
Molecular Weight:
221.0420
MDL Number:
MFCD18791600
IUPAC Name:
1-(bromomethyl)-3-(difluoromethyl)benzene
InChI:
InChI=1S/C8H7BrF2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,8H,5H2
InChI Key:
ZLEPJRZWCZMUGA-UHFFFAOYSA-N
SMILES:
BrCc1cccc(c1)C(F)F
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.97g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.045g/mol
Monoisotopic Mass:
219.97g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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