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89090-33-5 | Cyclopentanol, 1-[1-methyl-4-[3-(trifluoromethyl)phenyl]-4-piperidinyl]-
CAS No: 89090-33-5 Catalog No: AG003Z1Q MDL No:
Product Description
Catalog Number:
AG003Z1Q
Chemical Name:
Cyclopentanol, 1-[1-methyl-4-[3-(trifluoromethyl)phenyl]-4-piperidinyl]-
CAS Number:
89090-33-5
Molecular Formula:
C18H24F3NO
Molecular Weight:
327.3845
IUPAC Name:
1-[1-methyl-4-[3-(trifluoromethyl)phenyl]piperidin-4-yl]cyclopentan-1-ol
InChI:
InChI=1S/C18H24F3NO/c1-22-11-9-16(10-12-22,17(23)7-2-3-8-17)14-5-4-6-15(13-14)18(19,20)21/h4-6,13,23H,2-3,7-12H2,1H3
InChI Key:
MOLYBGVOXHOJCC-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)(c1cccc(c1)C(F)(F)F)C1(O)CCCC1
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.181g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.391g/mol
Monoisotopic Mass:
327.181g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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