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Home > Fluorides > 886496-24-8
886496-24-8 | 2,2,3,3,3-Pentafluoro-1-pyridin-4-yl-propan-1-ol
CAS No: 886496-24-8 Catalog No: AG01EYB2 MDL No:
Product Description
Catalog Number:
AG01EYB2
Chemical Name:
2,2,3,3,3-Pentafluoro-1-pyridin-4-yl-propan-1-ol
CAS Number:
886496-24-8
Molecular Formula:
C8H6F5NO
Molecular Weight:
227.1314
IUPAC Name:
2,2,3,3,3-pentafluoro-1-pyridin-4-ylpropan-1-ol
InChI:
InChI=1S/C8H6F5NO/c9-7(10,8(11,12)13)6(15)5-1-3-14-4-2-5/h1-4,6,15H
InChI Key:
GHROSUKBCNXPBP-UHFFFAOYSA-N
SMILES:
OC(C(C(F)(F)F)(F)F)c1ccncc1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.037g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.134g/mol
Monoisotopic Mass:
227.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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