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Home > Bromides > 1443344-01-1
1443344-01-1 | 3-Bromo-4'-(trifluoromethoxy)biphenyl
CAS No: 1443344-01-1 Catalog No: AG01FD6O MDL No:
Product Description
Catalog Number:
AG01FD6O
Chemical Name:
3-Bromo-4'-(trifluoromethoxy)biphenyl
CAS Number:
1443344-01-1
Molecular Formula:
C13H8BrF3O
Molecular Weight:
317.1012
IUPAC Name:
1-bromo-3-[4-(trifluoromethoxy)phenyl]benzene
InChI:
InChI=1S/C13H8BrF3O/c14-11-3-1-2-10(8-11)9-4-6-12(7-5-9)18-13(15,16)17/h1-8H
InChI Key:
PTUOIHUSEXFGHF-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)c1ccc(cc1)OC(F)(F)F
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.971g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.105g/mol
Monoisotopic Mass:
315.971g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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