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Home > Fluorides > 1263869-56-2
1263869-56-2 | trans-2-(3,4,5-Trifluorophenyl)cyclopentanol
CAS No: 1263869-56-2 Catalog No: AG01FALW MDL No:
Product Description
Catalog Number:
AG01FALW
Chemical Name:
trans-2-(3,4,5-Trifluorophenyl)cyclopentanol
CAS Number:
1263869-56-2
Molecular Formula:
C11H11F3O
Molecular Weight:
216.1996
IUPAC Name:
2-(3,4,5-trifluorophenyl)cyclopentan-1-ol
InChI:
InChI=1S/C11H11F3O/c12-8-4-6(5-9(13)11(8)14)7-2-1-3-10(7)15/h4-5,7,10,15H,1-3H2
InChI Key:
CMEDCFNGNXXZJI-UHFFFAOYSA-N
SMILES:
O[C@H]1CCC[C@@H]1c1cc(F)c(c(c1)F)F
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.076g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.203g/mol
Monoisotopic Mass:
216.076g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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