Ethirimol - analytical standard , CAS No.23947-60-6

CAS: 23947-60-6 Cat. No.: E114913 Molecular Weight: 209.29 Beilstein Registry Number: 882476 EC Number: 245-949-3
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GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
5-Butyl-2-(ethylamino)-4-hydroxy-6-methylpyrimidine | C18828 | Ethyrimol [ISO:French] | O-IODOHIPPURATE SODIUM 131I-LABELED FORM [MI] | AMY8987 | 5-butyl-2-ethylamino-6-methylpyrimidin-4-ol | Acetamide,2,2-dichloro-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
250mg
E114913-250mg
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Why this grade

analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal 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
5-Butyl-2-(ethylamino)-4-hydroxy-6-methylpyrimidine | C18828 | Ethyrimol [ISO:French] | O-IODOHIPPURATE SODIUM 131I-LABELED FORM [MI] | AMY8987 | 5-butyl-2-ethylamino-6-methylpyrimidin-4-ol | Acetamide, 2, 2-dichloro-N-[(1R, 2R)-2-hydroxy-1-(hydroxymethyl)-2
Specifications & Purity
analytical standard
Storage
Room temperature
Shipped In
Normal
Grade
Analytical standard
Names and Identifiers
Canonical SmilesCCCCC1=C(N=C(NC1=O)NCC)C
IUPAC Name5-butyl-2-(ethylamino)-4-methyl-1H-pyrimidin-6-one
InChIKeyBBXXLROWFHWFQY-UHFFFAOYSA-N
INCHI1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)
Isomeric SMILES CCCCC1=C(N=C(NC1=O)NCC)C
WGK Germany 1
RTECS UW7380000
Molecular Weight 209.29
Beilstein 882476
Reaxy-Rn 1572438
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1572438&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

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✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassDiazines
SubclassPyrimidines and pyrimidine derivatives
Intermediate Tree Nodes Not available
Direct ParentHydroxypyrimidines
Alternative Parents Hydropyrimidines  Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Hydroxypyrimidine - Hydropyrimidine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as hydroxypyrimidines. These are organic compounds containing a hydroxyl group attached to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors Pyrimidine fungicides
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Trypanosoma cruzi (99888 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
L6 (7924 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot NumberCertificate TypeDateItem
D1601203Certificate of AnalysisMay 15, 2025 E114913
Chemical and Physical Properties
Melt Point(°C)159-160°C
Molecular Weight209.290 g/mol
XLogP31.700
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass209.153 Da
Monoisotopic Mass209.153 Da
Topological Polar Surface Area53.500 Ų
Heavy Atom Count15
Formal Charge0
Complexity305.000
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
Solution Calculators
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