Litoxetine , CAS No.86811-09-8

CAS: 86811-09-8 Cat. No.: L667929 Molecular Weight: 241.33 PubChem CID: 65650
AVAILABLE TO ORDER
Synonyms
Litoxetine | 4-(2-Naphthylmethoxy)piperidine | 4-(naphthalen-2-ylmethoxy)piperidine | Litoxetine [INN] | 9980ST005G | SL 81-0385; SL 810385 | Litoxetina | Litoxetinum | Litoxetinum [INN-Latin] | Litoxetina [INN-Spanish] | UNII-9980ST005G | DTXSID30235828
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1mg
L667929-1mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$571.90

$999.90
Save $428.00 (42.80%)
5mg
L667929-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$1,999.90

$2,999.90
Save $1,000.00 (33.33%)
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Litoxetine | 4-(2-Naphthylmethoxy)piperidine | 4-(naphthalen-2-ylmethoxy)piperidine | Litoxetine [INN] | 9980ST005G | SL 81-0385; SL 810385 | Litoxetina | Litoxetinum | Litoxetinum [INN-Latin] | Litoxetina [INN-Spanish] | UNII-9980ST005G | DTXSID30235828
Storage
Room temperature
Action Type
INHIBITOR
Product Properties
ALogP2.9
Names and Identifiers
Canonical SmilesC1CNCCC1OCC2=CC3=CC=CC=C3C=C2
IUPAC Name4-(naphthalen-2-ylmethoxy)piperidine
InChIKeyMJJDYOLPMGIWND-UHFFFAOYSA-N
INCHI1S/C16H19NO/c1-2-4-15-11-13(5-6-14(15)3-1)12-18-16-7-9-17-10-8-16/h1-6,11,16-17H,7-10,12H2
Isomeric SMILES C1CNCCC1OCC2=CC3=CC=CC=C3C=C2
PubChem CID 65650
Molecular Weight 241.33

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassNaphthalenes
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentNaphthalenes
Alternative Parents Piperidines  Dialkylamines  Dialkyl ethers  Azacyclic compounds  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Naphthalene - Piperidine - Dialkyl ether - Secondary aliphatic amine - Ether - Secondary amine - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
SLC6A4 Tclin Sodium-dependent serotonin transporter (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
SLC6A2 Tclin Norepinephrine transporter (10102 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SLC6A4 Tclin Serotonin transporter (12625 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SLC6A3 Tclin Dopamine transporter (10535 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KCNH2 Tclin HERG (29587 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight241.330 g/mol
XLogP32.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass241.147 Da
Monoisotopic Mass241.147 Da
Topological Polar Surface Area21.300 Ų
Heavy Atom Count18
Formal Charge0
Complexity249.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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