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161045-76-7

161045-76-7 | Benzene, 4-bromo-2-fluoro-1-(1,1,2,3,3,3-hexafluoropropoxy)-

CAS No: 161045-76-7 Catalog No: AG001VLS MDL No:

Product Description

Catalog Number:
AG001VLS
Chemical Name:
Benzene, 4-bromo-2-fluoro-1-(1,1,2,3,3,3-hexafluoropropoxy)-
CAS Number:
161045-76-7
Molecular Formula:
C9H4BrF7O
Molecular Weight:
341.0203
IUPAC Name:
4-bromo-2-fluoro-1-(1,1,2,3,3,3-hexafluoropropoxy)benzene
InChI:
InChI=1S/C9H4BrF7O/c10-4-1-2-6(5(11)3-4)18-9(16,17)7(12)8(13,14)15/h1-3,7H
InChI Key:
OAIBMYMWAZXOKB-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)F)OC(C(C(F)(F)F)F)(F)F

Properties

Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.933g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.023g/mol
Monoisotopic Mass:
339.933g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5  

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