rel-(3R,4S)-4-(4-Fluorophenyl)-1-methyl-3-piperidinemethanol
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rel-(3R,4S)-4-(4-Fluorophenyl)-1-methyl-3-piperidinemethanol
structure -
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CAS No:
109887-53-8
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Formula:
C13H18FNO
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Chemical Name:
rel-(3R,4S)-4-(4-Fluorophenyl)-1-methyl-3-piperidinemethanol
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Synonyms:
3-Piperidinemethanol,4-(4-fluorophenyl)-1-methyl-,(3R,4S)-rel-;3-Piperidinemethanol,4-(4-fluorophenyl)-1-methyl-,trans-(±)-;rel-(3R,4S)-4-(4-Fluorophenyl)-1-methyl-3-piperidinemethanol;trans-4-(p-Fluorophenyl)-1-methyl-3-piperidinecarbinol;3-Piperidinemethanol,4-(4-fluorophenyl)-1-methyl-,trans-;(±)-trans-4-(4-Fluorophenyl)-3-(hydroxymethyl)-1-methylpiperidine;trans-4-(4-Fluorophenyl)-3-hydroxymethyl-N-methylpiperidine;(±)-trans-4-(p-Fluorophenyl)-3-(hydroxymethyl)-1-methylpiperidine;trans-N-Methyl-4-(4-fluorophenyl)-3-(hydroxymethyl)piperidine;trans-4-(4-Fluorophenyl)-3-(hydroxymethyl)-1-methylpiperidine;(±)-trans-4-(4′-Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine;trans-3-Hydroxymethyl-4-(4-fluorophenyl)-N-methylpiperidine;(±)-Paroxol
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CAS No:
rel-(3R,4S)-4-(4-Fluorophenyl)-1-methyl-3-piperidinemethanol Basic Attributes
223.28700
223.29
415-550-0
Safety Information
R36/37/38
S26-S37/39
Xi
|Danger|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P280, P301+P312, P305+P351+P338, P310, P330, P391, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P305+P351+P338, P310, P321, P330, P333+P313, P363, P391, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:223.29
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:223.137242360
Monoisotopic Mass:223.137242360
Topological Polar Surface Area:23.5
Heavy Atom Count:16
Complexity:216
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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