3-Ethoxythiobenzamide - Reagent grade , CAS No.747411-11-6

CAS: 747411-11-6 Cat. No.: E479439 Formule: C9H11NOS Poids moléculaire: 181.25 Numéro CE: 688-360-0
DISPONIBLE À COMMANDE
GRADE & PURITY Reagent Grade ? General reagent-grade purity suitable for most laboratory work. Use as a dependable default when no specific higher grade is required.
Synonyms
DTXSID60366533 | FT-0733415 | 3-Ethoxythiobenzamide, AldrichCPR | MFCD05270860 | 3-Ethoxythiobenzamide | Z56979299 | AKOS000203161 | 3-Ethoxybenzothioamide | 3-ETHOXYBENZENE-1-CARBOTHIOAMIDE | 3-ethoxybenzenecarbothioamide | NCGC00334820-01 | EN300-09494
Storage
Room temperature
★
Size
Allemagne (EU)
USA*
Price
Qty
1g
E479439-1g
Sur commande · 8–12 semaines

399,07€

466,76€
Enregistrer 67,68 € (14.50%)
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Why this grade

Reagent grade Reagent 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.

📋

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

Synonymes
DTXSID60366533 | FT-0733415 | 3-Ethoxythiobenzamide, AldrichCPR | MFCD05270860 | 3-Ethoxythiobenzamide | Z56979299 | AKOS000203161 | 3-Ethoxybenzothioamide | 3-ETHOXYBENZENE-1-CARBOTHIOAMIDE | 3-ethoxybenzenecarbothioamide | NCGC00334820-01 | EN300-09494
Spécifications et pureté
Reagent grade
Conditions de stockage de stockage
Room temperature
Grade
Reagent Grade
Noms et identifiants
Sourires canoniquesCCOC1=CC=CC(=C1)C(=S)N
IUPAC Name3-ethoxybenzenecarbothioamide
InChIKeyLXXDVDKIORLFFH-UHFFFAOYSA-N
INCHI1S/C9H11NOS/c1-2-11-8-5-3-4-7(6-8)9(10)12/h3-6H,2H2,1H3,(H2,10,12)
Isomères SMILES CCOC1=CC=CC(=C1)C(=S)N
Poids moléculaire 181.25
Reaxy-Rn 3238936
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3238936&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

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassePhenol ethers
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPhenol ethers
Alternative Parents Phenoxy compounds  Alkyl aryl ethers  Thioamides  Thiocarboxylic acid amides  Thiocarbonyl compounds  Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Thioamide - Ether - Thiocarboxylic acid amide - Organic nitrogen compound - Thiocarbonyl group - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors Not available
Structure 3D
Modèle de structure chimique interactif





Certificats (CoA, COO, BSE/TSE et tableau d'analyse)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriétés chimiques et physiques
Poids moléculaire181.260 g/mol
XLogP31.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass181.056 Da
Monoisotopic Mass181.056 Da
Topological Polar Surface Area67.300 Ų
Heavy Atom Count12
Formal Charge0
Complexity161.000
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
FAQ et articles
Calculateurs de solution
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