Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 7 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Sertraline Free Base is a Selective Serotonin Reuptake Inhibitor (SSRI). It can treat depression, obsessive-compulsive disorder (OCD), posttraumatic stress disorder (PTSD), premenstrual dysphoric disorder (PMDD), social anxiety disorder, and panic disorder.
| Canonical Smiles | CNC1CCC(C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl |
|---|---|
| IUPAC Name | (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine |
| InChIKey | VGKDLMBJGBXTGI-SJCJKPOMSA-N |
| INCHI | 1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17-/m0/s1 |
| Isomeric SMILES | CN[C@H]1CC[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl |
| PubChem CID | 68617 |
| Molecular Weight | 306.24 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Tetralins |
| Subclass | Tametralines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Tametralines |
| Alternative Parents | Dichlorobenzenes Aralkylamines Aryl chlorides Dialkylamines Organopnictogen compounds Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | Tametraline - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Secondary aliphatic amine - Secondary amine - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Amine - Organochloride - Organonitrogen compound - Aromatic homopolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as tametralines. These are compounds containing a tametraline moiety, which consists of a tetrahydronaphthalene linked to a phenyl group to form N-methyl-4-phenyl-1,2,3,4-tetrahydronaphthalen-1-amine skeleton. |
| External Descriptors | secondary amino compound - dichlorobenzene - tetralins |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Jul 26, 2025 | S613543 | |
| Certificate of Analysis | Jul 26, 2025 | S613543 | |
| Certificate of Analysis | Jul 26, 2025 | S613543 | |
| Certificate of Analysis | Jul 26, 2025 | S613543 |
| Molecular Weight | 306.200 g/mol |
|---|---|
| XLogP3 | 4.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 305.074 Da |
| Monoisotopic Mass | 305.074 Da |
| Topological Polar Surface Area | 12.000 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 322.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Qianqian Shang, Huajing Liu, Hang Mei, Chuixiu Huang, Xiantao Shen. (2022) Multi-extraction system with identical supported semi-liquid membrane: Enhanced stability for coextraction of acidic and basic drugs. TALANTA, [PMID:35462249] [10.1016/j.talanta.2022.123485] |
| 2. Ruiqin Zhu, Hang Mei, Huajing Liu, Changbao Hong, Xiantao Shen, Chuixiu Huang. (2021) Successive liquid-phase microextraction of acidic and basic analytes. ANALYTICA CHIMICA ACTA, [PMID:35057942] [10.1016/j.aca.2021.339335] |
| 3. Yan-Qing Wang, Chun-Yun Tan, Shu-Lin Zhuang, Peng-Zhan Zhai, Yun Cui, Qiu-Hua Zhou, Hong-Mei Zhang, Zhenghao Fei. (2014) In vitro and in silico investigations of the binding interactions between chlorophenols and trypsin. JOURNAL OF HAZARDOUS MATERIALS, [PMID:24953936] [10.1016/j.jhazmat.2014.05.092] |
| 4. Xinxin Zheng, Sidi Cun, Jiatai Yin, Xue Zhao, Yunshan Wang, Jing Wang, Qian Li, Xinfeng Zhao. (2025) Immobilizing the Endogenous 5-Hydroxytryptamine Transporter by Ligand-Directed and Proximity-Catalyzed Acyl Imidazole Chemistry for Affinity Chromatographic Analysis. ANALYTICAL CHEMISTRY, [PMID:40317770] [10.1021/acs.analchem.5c01334] |
| 5. Xue Zhao, Yunshan Wang, Jiatai Yin, Sidi Cun, Yuanyuan Ou, Qian Li, Xinfeng Zhao, Yajun Zhang. (2025) Integrating click chemistry into protein expression for efficient preparation of immobilized protein bio-surface with enhanced stability and reproducibility in affinity chromatography. ANALYTICA CHIMICA ACTA, [PMID:40409903] [10.1016/j.aca.2025.344142] |
| 6. Zhao Xue, Yu Yi, Yang Lili, Liu Hui, Lei Ting. (2025) Screening of selective serotonin reuptake inhibitors from Cyperus rotundus using immobilized neurotransmitter transporter affinity chromatography for antidepressant discovery. ANALYTICAL AND BIOANALYTICAL CHEMISTRY, [PMID:41062859] [10.1007/s00216-025-06105-6] |
| 7. Yunshan Wang, Nan Lu, Peiyao Wu, Yue Chu, Yonghao Xing, Jing Wang, Xinfeng Zhao. (2026) An Allosteric Assay for Identifying Ligands Binding to β2 Adrenergic Receptor by Surface-Enhanced Raman Scattering (SERS)-Active Nanoparticles. ANALYTICAL CHEMISTRY, [PMID:41637639] [10.1021/acs.analchem.5c07045] |
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