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88469-46-9 | Benzene, 1-phenoxy-2-(3,3,3-trifluoropropyl)-
CAS No: 88469-46-9 Catalog No: AG004C59 MDL No:
Product Description
Catalog Number:
AG004C59
Chemical Name:
Benzene, 1-phenoxy-2-(3,3,3-trifluoropropyl)-
CAS Number:
88469-46-9
Molecular Formula:
C15H13F3O
Molecular Weight:
266.2583
IUPAC Name:
1-phenoxy-2-(3,3,3-trifluoropropyl)benzene
InChI:
InChI=1S/C15H13F3O/c16-15(17,18)11-10-12-6-4-5-9-14(12)19-13-7-2-1-3-8-13/h1-9H,10-11H2
InChI Key:
YMHVSDJPTDCWEY-UHFFFAOYSA-N
SMILES:
FC(CCc1ccccc1Oc1ccccc1)(F)F
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.092g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.263g/mol
Monoisotopic Mass:
266.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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