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Home > Bromides > 1342665-29-5
1342665-29-5 | 1-Bromo-3-(3,3,3-trifluoropropoxy)benzene
CAS No: 1342665-29-5 Catalog No: AG01ESA6 MDL No:MFCD20390707
Product Description
Catalog Number:
AG01ESA6
Chemical Name:
1-Bromo-3-(3,3,3-trifluoropropoxy)benzene
CAS Number:
1342665-29-5
Molecular Formula:
C9H8BrF3O
Molecular Weight:
269.0584
MDL Number:
MFCD20390707
IUPAC Name:
1-bromo-3-(3,3,3-trifluoropropoxy)benzene
InChI:
InChI=1S/C9H8BrF3O/c10-7-2-1-3-8(6-7)14-5-4-9(11,12)13/h1-3,6H,4-5H2
InChI Key:
ZYKFBBWDGSWGBB-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)OCCC(F)(F)F
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.971g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.061g/mol
Monoisotopic Mass:
267.971g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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