4'-(1-Pyrazolyl)acetophenone - ≥98% , CAS No.25699-98-3

CAS: 25699-98-3 Cat. No.: P588443 Molecular Weight: 186.21 EC Number: 959-794-0 PubChem CID: 12238134
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
MFCD08572143 | 1-(4-pyrazol-1-ylphenyl)ethanone | 1-(4-pyrazol-1-yl-phenyl)ethanone | 1-(4-pyrazol-1-yl-phenyl)-ethanone | SGXKUEXZFMNYRE-UHFFFAOYSA-N | Ethanone, 1-[4-(1H-pyrazol-1-yl)phenyl]- | EN300-27358 | F8880-3352 | DTXSID50481840 | 4'-(1-Pyrazolyl
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
P588443-1g
3

$13.90

$20.90
Save $7.00 (33.49%)
5g
P588443-5g
2

$28.90

$43.90
Save $15.00 (34.17%)
25g
P588443-25g
1

$108.90

$163.90
Save $55.00 (33.56%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice 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.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
MFCD08572143 | 1-(4-pyrazol-1-ylphenyl)ethanone | 1-(4-pyrazol-1-yl-phenyl)ethanone | 1-(4-pyrazol-1-yl-phenyl)-ethanone | SGXKUEXZFMNYRE-UHFFFAOYSA-N | Ethanone, 1-[4-(1H-pyrazol-1-yl)phenyl]- | EN300-27358 | F8880-3352 | DTXSID50481840 | 4'-(1-Pyrazolyl
Specifications & Purity
≥98%
Storage
Store at 2-8°C, Desiccated
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%
Names and Identifiers
Pubchem Sid504767006
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504767006
Canonical SmilesCC(=O)C1=CC=C(C=C1)N2C=CC=N2
IUPAC Name1-(4-pyrazol-1-ylphenyl)ethanone
InChIKeySGXKUEXZFMNYRE-UHFFFAOYSA-N
INCHI1S/C11H10N2O/c1-9(14)10-3-5-11(6-4-10)13-8-2-7-12-13/h2-8H,1H3
Isomeric SMILES CC(=O)C1=CC=C(C=C1)N2C=CC=N2
PubChem CID 12238134
Molecular Weight 186.21

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 - Phenylketones
Direct ParentAlkyl-phenylketones
Alternative Parents Phenylpyrazoles  Acetophenones  Benzoyl derivatives  Aryl alkyl ketones  Heteroaromatic compounds  Azacyclic compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Alkyl-phenylketone - Phenylpyrazole - Acetophenone - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Pyrazole - Azole - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl 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:

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

6 results found

Lot NumberCertificate TypeDateItem
J2318097Certificate of AnalysisSep 27, 2023 P588443
J2318099Certificate of AnalysisSep 27, 2023 P588443
J2318100Certificate of AnalysisSep 27, 2023 P588443
J2318117Certificate of AnalysisSep 27, 2023 P588443
J2318265Certificate of AnalysisSep 27, 2023 P588443
J2318266Certificate of AnalysisSep 27, 2023 P588443
Chemical and Physical Properties
Molecular Weight186.210 g/mol
XLogP31.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass186.079 Da
Monoisotopic Mass186.079 Da
Topological Polar Surface Area34.900 Ų
Heavy Atom Count14
Formal Charge0
Complexity209.000
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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