AG000NDK

125224-43-3 | 3-Piperidinemethanol, 4-(4-fluorophenyl)-, (3S,4R)-

AG000NDK

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CAS Number	125224-43-3
Catalog Number	AG000NDK(AGN-PC-0O0QFD)
Chemical Name	3-Piperidinemethanol, 4-(4-fluorophenyl)-, (3S,4R)-
IUPAC Name	[(3S,4R)-4-(4-fluorophenyl)piperidin-3-yl]methanol
InChI	InChI=1S/C12H16FNO/c13-11-3-1-9(2-4-11)12-5-6-14-7-10(12)8-15/h1-4,10,12,14-15H,5-8H2/t10-,12-/m0/s1
InChI Key	IBOPBHBOBJYXTD-JQWIXIFHSA-N
MDL Number	MFCD03839921
Molecular Formula	C12H16FNO
Molecular Weight	209.2599
SMILES	OC[C@@H]1CNCC[C@H]1C2=CC=C(F)C=C2
Synonyms	125224-43-3, ((3S,4R)-4-(4-fluorophenyl)piperidin-3-yl)methanol, [(3S,4R)-4-(4-fluorophenyl)piperidin-3-yl]methanol, N-DESMETHYL PAROXOL, trans-4-(4-fluorophenyl)-3-hydroxymethylpiperidine, 3-PIPERIDINEMETHANOL, 4-(4-FLUOROPHENYL)-, (3S,4R)-, (3S,4R)-(-)-4-(4'-FLUOROPHENYL)3-HYDROXYMETHYL)-PIPERIDINE, 188869-26-3, Racemic-[(3S,4R)-4-(4-fluorophenyl)piperidin-3-yl]methanol, (3S,4R)-(-)-4-(4'-FLUOROPHENYL)-3-HYDROXYMETHYL-PIPERIDINE, N-Desmethyl Paroxol Hydrochloride, trans-4-(4'-Fluorophenyl)3-hydroxymethyl)-piperidine, (3S,4R)-4-(4-FLUOROPHENYL)PIPERIDINE-3-METHANOL, (3S,4R)-[4-(4-Fluoro-phenyl)-piperidin-3-yl]-methanol, AK-55338, (3S,4R)-4-(4-Fluorophenyl)piperidine-3-methanol Hydrochloride, PubChem23483, (3S,4R)-(-)-4-(4-Fluorophenyl)-3-piperidinemethanol, AC1Q77QW, PAROXETINE IMPURITY I, SCHEMBL4428153, CHEMBL3544674, CTK7J7209, IBOPBHBOBJYXTD-JQWIXIFHSA-N, (3S,4R)-(-)-4-(4-Fluorophenyl)3-hydroxymethyl)-piperidine, ACT02074, (3S,4R)-(-)-(4-(4'-FLUOROPHENYL)3-HYDROXYMETHYL)-PIPERIDINE, ANW-47972, BLR-35961, CF-558, MFCD03839854, MFCD03839921, PC1507, ZINC12647820, AKOS015919686, AB16312, AS06729, CS-W005772, FS-2280, PC53318, RTX-010123, AJ-62685, BR-55338, DA-18323, AB0004925, AX8035761, ST2414057, X9618, S-6547, A805359, (3S,4R)-4-(4-Fluorophenyl)-3-piperidinemethanol, S14-2862, trans-4-(4'-fluorophenyl)3-hydroxymethyl-piperidine, trans-4-(4-Fluorophenyl)-3-hydroxymethyl piperidine, [(3S,4R)-4-(4-fluorophenyl)-3-piperidinyl]methanol, trans-[4-(4-fluoro-phenyl)-piperidin-3-yl]-methanol, (3s,4r)-3-hydroxymethyl-4-(4-fluorophenyl) piperidine, [(3S,4R)-4-(4-fluorophenyl)piperidine-3-yl]methanol, trans-(-)-4-(4-fluorophenyl)-3-hydroxymethylpiperidine, trans-4-(4'-fluorophenyl)3-(hydroxymethyl)-piperidine, (+/-)-trans-4-(4'-Fluorophenyl)-3-hydroxymethylpiperidine, (+/-)-trans-4-(4-fluorophenyl)-3-hydroxymethylpiperidine, (-)-(3S,4R)-4-(4-fluorophenyl)-3-hydroxymethylpiperidine, (3S,4R)-4-(4-Fluorophenyl)-3-piperidinemethanol Hydrochloride, (3sr,4rs)-trans-4-(4-fluorophenyl)-3-hydroxymethyl piperidine, (3sr-4rs)-trans-4-(4-fluorophenyl)-3-hydroxymethylpiperidine, (3S,4R)-(-)-4-(4-Fluorophenyl)-3-piperidinemethanol Hydrochloride, (3S-4RS)-TRANS-4-(4-FLUOROPHENYL)-3-HYDROXYMETHYLPIPERIDINE, (3S-trans)-4-(4-Fluorophenyl)-3-piperidinemethanol Hydrochloride, trans-4-(4'-Fluorophenyl)-3-(hydroxymethyl)-piperidine, AldrichCPR, (3S,4R)-(-)-(4-(4'-fluorophenyl)3-hydroxymethyl)-piperidine, AldrichCPR, [(3S,4R)-4-(4-Fluorophenyl)piperidin-3-yl]methanol (N-Desmethylparoxol), C12H16FNO, Paroxetine Anhydrous EP Impurity I, ACN-037813, CID9855829, CS-O-15358, [4-(4-fluorophenyl)-3-piperidyl]methanol, trans-(4-(4'-fluorophenyl)-3-hydroxymethyl)-piperidine, (3S,4R)-(-)-4-(4-Fluorophenyl)-3-piperidine methanol, 109887-53-8, 220548-73-2, 872544-48-4,

Complexity	192
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	209.122g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	209.264g/mol
Monoisotopic Mass	209.122g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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