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Home > Fluorides > 1198287-31-8
1198287-31-8 | 4-Hydroxy-4-(3,4,5-trifluorophenyl)-1-methylpiperidine
CAS No: 1198287-31-8 Catalog No: AG01F7WE MDL No:
Product Description
Catalog Number:
AG01F7WE
Chemical Name:
4-Hydroxy-4-(3,4,5-trifluorophenyl)-1-methylpiperidine
CAS Number:
1198287-31-8
Molecular Formula:
C12H14F3NO
Molecular Weight:
245.2409
IUPAC Name:
1-methyl-4-(3,4,5-trifluorophenyl)piperidin-4-ol
InChI:
InChI=1S/C12H14F3NO/c1-16-4-2-12(17,3-5-16)8-6-9(13)11(15)10(14)7-8/h6-7,17H,2-5H2,1H3
InChI Key:
HKAAGGUOMNDBNX-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)(O)c1cc(F)c(c(c1)F)F
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.103g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.245g/mol
Monoisotopic Mass:
245.103g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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