556823
4-(4-Chloro-3-(trifluoromethyl)phenyl)-4-piperidinol
97%
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About This Item
Empirical Formula (Hill Notation):
C12H13ClF3NO
CAS Number:
Molecular Weight:
279.69
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
244-665-7
MDL number:
Assay:
97%
InChI key
RALRVIPTUXSBPO-UHFFFAOYSA-N
InChI
1S/C12H13ClF3NO/c13-10-2-1-8(7-9(10)12(14,15)16)11(18)3-5-17-6-4-11/h1-2,7,17-18H,3-6H2
SMILES string
OC1(CCNCC1)c2ccc(Cl)c(c2)C(F)(F)F
assay
97%
mp
138-141 °C (lit.)
Application
4-(4-Chloro-3-(trifluoromethyl)phenyl)-4-piperidinol may be used to synthesize piperidinols and penfluridol (a neuroleptic agent).
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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Rhodium catalyzed hydroformylation of 1, 1-bis (p-fluorophenyl) allyl or propargyl alcohol: a key step in the synthesis of Fluspirilen and Penfluridol.
Botteghi C, et al.
Tetrahedron, 57(8), 1631-1637 (2001)
Dianqing Sun et al.
Bioorganic & medicinal chemistry, 17(10), 3588-3594 (2009-04-24)
Direct anti-tuberculosis screening of commercially available compound libraries identified a novel piperidinol with interesting anti-tuberculosis activity and drug like characteristics. To generate a structure activity relationship about this hit a 22 member optimization library was generated using parallel synthesis. Products
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