(+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine

Basic Information

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CAS Number

109887-53-8

Molecular Formula

C13H18FNO

Molecular Weight

223.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

115-121°C

Boiling Point

300.3°Cat760mmHg

Density

1.092

Flash Point

300.3°Cat760mmHg

Refractive Index

1.518

SMILES

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CN1CCC(C(C1)CO)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H18FNO/c1-15-7-6-13(11(8-15)9-16)10-2-4-12(14)5-3-10/h2-5,11,13,16H,6-9H2,1H3/t11-,13-/m1/s1

InChIKey

CXRHUYYZISIIMT-DGCLKSJQSA-N

LogP

1.8533

Topological Polar Surface Area

23.47 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

216

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

NS00134694
AKOS005063663
SB49401
SB43824
BCP25072
SY013729
BCP12375
((3R,4R)-4-(4-Fluorophenyl)-1-methylpiperidin-3-yl)methanol
4-(4-Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine
[4-(4-Fluoro-phenyl)-1-methyl-piperidin-3-yl]-methanol? (Paroxetine Impurity pound(c)
109887-53-8
[4-(4-fluorophenyl)-1- methylpiperidin-3-yl]methanol
4-(4-Fluorophenyl)-3-hydroxymethyl-1-methyl-piperidine
(+/-)-TRANS-4-(FLUOROPHENYL)-3-HYDROXYMETHYL-1-METHYLPIPERIDINE
CS-0165676
Paroxetine Impurity 18
SB45323
(+)-Paroxol;((3R,4S)-4-(4-Fluorophenyl)-1-methylpiperidin-3-yl)methanol
[4-(4-fluorophenyl)-1-methyl-piperidin-3-yl]methanol
starbld0018161
[4-(4-fluorophenyl)-1-methylpiperidin-3-yl]methanol
N-ACETYL-L-CYSTEINEMETHYLESTER
4-(p-flurophenyl)-3-hydroxymethyl-N-methyl-piperidine
DTXSID10871546
318279-38-8
ent-Paroxol
(3R,4S)-4-(4-Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine
4-(3,3-DIMETHYL-5-OXO-CYCLOHEXYLIDENEAMINO)-BENZOICACID
Trans-4-(4-Fluorophenyl)-3-hydroxymethyl-1-methyl-piperidine
CXRHUYYZISIIMT-UHFFFAOYSA-N
(+/-)4-p-Fluorophenyl-3-hydroxymethyl-1-methylpiperidine

MDL Number

MFCD02093092

FAQ

What regulatory guidelines apply to (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8)?

The regulation of (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8) primarily includes the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which categorizes it based on its health and physical hazards. In the European Union, it falls under the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulation, which requires manufacturers and importers to register substances above one tonne per year. Additionally, the U.S. Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) have specific guidelines regarding the use and disposal of this compound to ensure safety and environmental protection.

Are there alternatives to (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8) in synthesis?

There are several alternatives to (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8) in synthesis. Common alternatives include (-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine and (+)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine, which are enantiomers. Other substitute solutions might involve using simpler piperidine derivatives or related fluorophenyl compounds that can serve similar functional roles in various chemical reactions.

What is the market or research trend for (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8)?

The market trend for (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8) is driven by its applications in pharmaceuticals and organic synthesis. Recent research trends focus on its use in developing novel therapeutic agents and as a key intermediate in the synthesis of complex molecules. Price trends are influenced by supply and demand, with a growing interest in sustainable and efficient synthesis methods. Emerging research fields include the exploration of its potential in drug discovery and as a precursor for advanced materials.

How should waste containing (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8) be handled?

Waste containing (+/-)-Trans-4-(fluorophenyl)-3-hydroxymethyl-1-methylpiperidine (CAS: 109887-53-8) should be managed with care to ensure safety and environmental protection. Waste collection should be conducted in appropriate containers labeled with the chemical name and CAS number. For waste disposal, it is recommended to use professional hazardous waste disposal services. Incineration is a common method, but it must be done in industrial incinerators with proper air pollution control systems. In addition, it is crucial to follow local and international regulations for the handling and disposal of hazardous chemicals to prevent environmental contamination and ensure public safety.