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· · COA & SDS available for every product · Same-day shipping on in-stock items 3-(3-(Naphthalen-1-yloxy)propyl)-1H-indole-2-carboxylic acid , CAS No.1072899-39-8
Synonyms
3-(3-(Naphthalen-1-yloxy)propyl)-1H-indole-2-carboxylic acid | 3-{3-[(Naphthalen-1-yl)oxy]propyl}-1H-indole-2-carboxylic acid | 3-[3-(NAPHTHALEN-1-YLOXY)PROPYL]-1H-INDOLE-2-CARBOXYLIC ACID | DTXSID80648707 | IQTBMDSOBZUIII-UHFFFAOYSA-N | BDBM50424734 | PD
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
3-(3-(Naphthalen-1-yloxy)propyl)-1H-indole-2-carboxylic acid | 3-{3-[(Naphthalen-1-yl)oxy]propyl}-1H-indole-2-carboxylic acid | 3-[3-(NAPHTHALEN-1-YLOXY)PROPYL]-1H-INDOLE-2-CARBOXYLIC ACID | DTXSID80648707 | IQTBMDSOBZUIII-UHFFFAOYSA-N | BDBM50424734 | PD
Product Properties Names and Identifiers Canonical Smiles C1=CC=C2C(=C1)C=CC=C2OCCCC3=C(NC4=CC=CC=C43)C(=O)O IUPAC Name 3-(3-naphthalen-1-yloxypropyl)-1H-indole-2-carboxylic acid InChIKey IQTBMDSOBZUIII-UHFFFAOYSA-N INCHI 1S/C22H19NO3/c24-22(25)21-18(17-10-3-4-12-19(17)23-21)11-6-14-26-20-13-5-8-15-7-1-2-9-16(15)20/h1-5,7-10,12-13,23H,6,11,14H2,(H,24,25) Isomeric SMILES C1=CC=C2C(=C1)C=CC=C2OCCCC3=C(NC4=CC=CC=C43)C(=O)O Molecular Weight 345.4 Reaxy-Rn 18654587 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=18654587&ln=
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 Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Indoles and derivatives Subclass Indolecarboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Indolecarboxylic acids and derivatives Alternative Parents Naphthalenes 3-alkylindoles Pyrrole 2-carboxylic acids Phenol ethers Alkyl aryl ethers Substituted pyrroles Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Indolecarboxylic acid derivative - Naphthalene - 3-alkylindole - Indole - Phenol ether - Pyrrole-2-carboxylic acid - Pyrrole-2-carboxylic acid or derivatives - Alkyl aryl ether - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Carboxylic acid derivative - Ether - Carboxylic acid - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 345.400 g/mol XLogP3 5.400 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 6 Exact Mass 345.136 Da Monoisotopic Mass 345.136 Da Topological Polar Surface Area 62.300 Ų Heavy Atom Count 26 Formal Charge 0 Complexity 482.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 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
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