1-(4,6-dichloropyrimidin-5-yl)ethan-1-one - ≥97% , CAS No.60025-06-1

CAS: 60025-06-1 Cat. No.: E635990 Molecular Weight: 191.01 EC Number: 848-964-9 PubChem CID: 12278259
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
AKOS022185532 | 1-(4,6-dichloro-pyrimidin-5-yl)-ethanone | 1-(4,6-DICHLOROPYRIMIDIN-5-YL)ETHANONE | 1-(4,6-dichloropyrimidin-5-yl)ethan-1-one | Z1255444091 | DS-5054 | Ethanone, 1-(4,6-dichloro-5-pyrimidinyl)- | AMOPGZSOKQKCHT-UHFFFAOYSA-N | FT-0743623 |
Storage
Room temperature
Shipped In
Normal
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Price
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100mg
E635990-100mg
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$12.90

$19.90
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250mg
E635990-250mg
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$19.90

$29.90
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1g
E635990-1g
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$27.90

$41.90
Save $14.00 (33.41%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

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
AKOS022185532 | 1-(4, 6-dichloro-pyrimidin-5-yl)-ethanone | 1-(4, 6-DICHLOROPYRIMIDIN-5-YL)ETHANONE | 1-(4, 6-dichloropyrimidin-5-yl)ethan-1-one | Z1255444091 | DS-5054 | Ethanone, 1-(4, 6-dichloro-5-pyrimidinyl)- | AMOPGZSOKQKCHT-UHFFFAOYSA-N | FT-0743623 |
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Canonical SmilesCC(=O)C1=C(N=CN=C1Cl)Cl
IUPAC Name1-(4,6-dichloropyrimidin-5-yl)ethanone
InChIKeyAMOPGZSOKQKCHT-UHFFFAOYSA-N
INCHI1S/C6H4Cl2N2O/c1-3(11)4-5(7)9-2-10-6(4)8/h2H,1H3
Isomeric SMILES CC(=O)C1=C(N=CN=C1Cl)Cl
Alternate CAS 60025-06-1
PubChem CID 12278259
Molecular Weight 191.01

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
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Aryl ketones
Direct ParentAryl alkyl ketones
Alternative Parents Halopyrimidines  Aryl chlorides  Vinylogous halides  Heteroaromatic compounds  Azacyclic compounds  Organonitrogen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Aryl alkyl ketone - Halopyrimidine - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Vinylogous halide - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight191.010 g/mol
XLogP31.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass189.97 Da
Monoisotopic Mass189.97 Da
Topological Polar Surface Area42.900 Ų
Heavy Atom Count11
Formal Charge0
Complexity155.000
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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