Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥95% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504762345 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504762345 |
| Canonical Smiles | CCN1CCCC1CNC(=O)C2=C(C(=CC(=C2OC)Cl)Cl)O |
| IUPAC Name | 3,5-dichloro-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-6-methoxybenzamide |
| InChIKey | WAOQONBSWFLFPE-VIFPVBQESA-N |
| INCHI | 1S/C15H20Cl2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1 |
| Isomeric SMILES | CCN1CCC[C@H]1CNC(=O)C2=C(C(=CC(=C2OC)Cl)Cl)O |
| RTECS | CV3463500 |
| Alternate CAS | 84225-95-6 |
| PubChem CID | 3033769 |
| MeSH Entry Terms | C11, Raclopride;FLA 870;FLA-870;FLA870;FLB 472;FLB-472;FLB472;Raclopride;Raclopride C11 |
| Molecular Weight | 347.24 |
| Reaxy-Rn | 3559819 |
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 | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Hydroxybenzoic acid derivatives - Salicylic acid and derivatives |
| Direct Parent | Salicylamides |
| Alternative Parents | Methoxyphenols 3-halobenzoic acids and derivatives Benzamides Benzoyl derivatives Dichlorobenzenes Anisoles Methoxybenzenes O-chlorophenols P-chlorophenols Phenoxy compounds Alkyl aryl ethers N-alkylpyrrolidines Aryl chlorides Vinylogous acids Amino acids and derivatives Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Salicylamide - Methoxyphenol - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Phenol ether - 4-chlorophenol - 2-chlorophenol - Phenoxy compound - 1,3-dichlorobenzene - Methoxybenzene - 4-halophenol - 2-halophenol - Benzoyl - Anisole - Halobenzene - Alkyl aryl ether - Phenol - Chlorobenzene - Aryl chloride - Aryl halide - N-alkylpyrrolidine - Pyrrolidine - Vinylogous acid - Secondary carboxylic acid amide - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Organoheterocyclic compound - Ether - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organopnictogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organochloride - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as salicylamides. These are carboxamide derivatives of salicylic acid. Salicylic acid is the ortho-hydroxylated derivative of benzoic acid. |
| External Descriptors | Not available |
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| Solubility | Soluble in Methanol |
|---|---|
| Sensitivity | Air Sensitive |
| Specific Rotation[α] | -70° (C=2,Acetone) |
| Melt Point(°C) | 54 °C |
| Molecular Weight | 347.200 g/mol |
| XLogP3 | 2.900 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 346.085 Da |
| Monoisotopic Mass | 346.085 Da |
| Topological Polar Surface Area | 61.800 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 386.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| 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. Jinxin Yu, Jiayi He, Xin Gong, Jimin Xu, Yongqiang Bai, Yiqiang Tian, Xilian Yang, Xinnian Zeng, Jiali Liu. (2025) The role of dopamine signaling in olfactory associative learning and memory in the oriental fruit fly, Bactrocera dorsalis. PESTICIDE BIOCHEMISTRY AND PHYSIOLOGY, [PMID:41326102] [10.1016/j.pestbp.2025.106740] |
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