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· · COA & SDS available for every product · Same-day shipping on in-stock items 7-(Diethylamino)-4-(hydroxymethyl)coumarin - ≥98% , CAS No.54711-38-5
Synonyms
doi:10.14272/NMZSXNOCNJMJQT-UHFFFAOYSA-N.1 | D4970 | 7-(Diethylamino)-4-(hydroxymethyl)-2H-chromen-2-one | 7-(diethylamino)-4-(hydroxymethyl)chromen-2-one | AKOS027325190 | DTXSID70561350 | Coumarin-OH | 7-(N,N-diethylamino)-4-(hydroxymethyl)coumarin | C1
Storage
Store at 2-8°C,Protected from light
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C,Protected from light Ships Wet ice 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
doi:10.14272/NMZSXNOCNJMJQT-UHFFFAOYSA-N.1 | D4970 | 7-(Diethylamino)-4-(hydroxymethyl)-2H-chromen-2-one | 7-(diethylamino)-4-(hydroxymethyl)chromen-2-one | AKOS027325190 | DTXSID70561350 | Coumarin-OH | 7-(N, N-diethylamino)-4-(hydroxymethyl)coumarin | C1
Specifications & Purity
≥98%
Storage
Store at 2-8°C, Protected from light
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid 504767663 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504767663 Canonical Smiles CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)CO IUPAC Name 7-(diethylamino)-4-(hydroxymethyl)chromen-2-one InChIKey NMZSXNOCNJMJQT-UHFFFAOYSA-N INCHI 1S/C14H17NO3/c1-3-15(4-2)11-5-6-12-10(9-16)7-14(17)18-13(12)8-11/h5-8,16H,3-4,9H2,1-2H3 Isomeric SMILES CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)CO Molecular Weight 247.29 Reaxy-Rn 4749928 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4749928&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 Phenylpropanoids and polyketides Class Coumarins and derivatives Subclass Not available Intermediate Tree Nodes Not available Direct Parent Coumarins and derivatives Alternative Parents 1-benzopyrans Dialkylarylamines Pyranones and derivatives Benzenoids Heteroaromatic compounds Lactones Oxacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives Aromatic alcohols Molecular Framework Aromatic heteropolycyclic compounds Substituents Coumarin - Benzopyran - 1-benzopyran - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Pyranone - Pyran - Benzenoid - Heteroaromatic compound - Lactone - Tertiary amine - Oxacycle - Organoheterocyclic compound - Alcohol - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic alcohol - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one). 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) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Light sensitive Melt Point(°C) 143 °C Molecular Weight 247.290 g/mol XLogP3 1.900 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 4 Exact Mass 247.121 Da Monoisotopic Mass 247.121 Da Topological Polar Surface Area 49.800 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 336.000 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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