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Home > Bromides > 1823550-05-5
1823550-05-5 | 6-Bromo-1-(difluoromethyl)-2,3,4-trifluorobenzene
CAS No: 1823550-05-5 Catalog No: AG01F9D1 MDL No:MFCD28166244
Product Description
Catalog Number:
AG01F9D1
Chemical Name:
6-Bromo-1-(difluoromethyl)-2,3,4-trifluorobenzene
CAS Number:
1823550-05-5
Molecular Formula:
C7H2BrF5
Molecular Weight:
260.9868
MDL Number:
MFCD28166244
IUPAC Name:
1-bromo-2-(difluoromethyl)-3,4,5-trifluorobenzene
InChI:
InChI=1S/C7H2BrF5/c8-2-1-3(9)5(10)6(11)4(2)7(12)13/h1,7H
InChI Key:
ZCFGGGRQSWIMIG-UHFFFAOYSA-N
SMILES:
FC(c1c(Br)cc(c(c1F)F)F)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.926g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.989g/mol
Monoisotopic Mass:
259.926g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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