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Home > Bromides > 1807026-77-2
1807026-77-2 | Benzene, 2-bromo-1-(difluoromethoxy)-3-(trifluoromethyl)-
CAS No: 1807026-77-2 Catalog No: AG002295 MDL No:
Product Description
Catalog Number:
AG002295
Chemical Name:
Benzene, 2-bromo-1-(difluoromethoxy)-3-(trifluoromethyl)-
CAS Number:
1807026-77-2
Molecular Formula:
C8H4BrF5O
Molecular Weight:
291.0128
IUPAC Name:
2-bromo-1-(difluoromethoxy)-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H4BrF5O/c9-6-4(8(12,13)14)2-1-3-5(6)15-7(10)11/h1-3,7H
InChI Key:
UZZTUBXFRQJUFW-UHFFFAOYSA-N
SMILES:
FC(Oc1cccc(c1Br)C(F)(F)F)F
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.937g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.015g/mol
Monoisotopic Mass:
289.937g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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