4′-(Imidazol-1-yl)acetophenone - ≥96% , CAS No.10041-06-2

CAS: 10041-06-2 Cat. No.: I165364 Molecular Weight: 186.21 EC Number: 233-123-5
AVAILABLE TO ORDER
GRADE & PURITY ≥96%
Synonyms
1-(4-(1H-Imidazol-1-yl)phenyl)ethanone | 10A-004 | Ambroxol theophyllinacetate | 4'-(imidazol-1-yl) acetophenone | EINECS 233-123-5 | IMIDAZOLACETOPHENONE | 1-(4-(1H-imidazol-1-yl)phenyl)ethan-1-one | SCHEMBL611481 | US9144538, 4'-(Imidazol-1yl) acetophen
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
I165364-1g
2

$15.90

$23.90
Save $8.00 (33.47%)
5g
I165364-5g
9

$51.90

$77.90
Save $26.00 (33.38%)
25g
I165364-25g
1

$181.90

$272.90
Save $91.00 (33.35%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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
1-(4-(1H-Imidazol-1-yl)phenyl)ethanone | 10A-004 | Ambroxol theophyllinacetate | 4'-(imidazol-1-yl) acetophenone | EINECS 233-123-5 | IMIDAZOLACETOPHENONE | 1-(4-(1H-imidazol-1-yl)phenyl)ethan-1-one | SCHEMBL611481 | US9144538, 4'-(Imidazol-1yl) acetophen
Specifications & Purity
≥96%
Storage
Room temperature
Shipped In
Normal
Action Type
INHIBITOR
Purity
≥96%
Names and Identifiers
Pubchem Sid488186083
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488186083
Canonical SmilesCC(=O)C1=CC=C(C=C1)N2C=CN=C2
IUPAC Name1-(4-imidazol-1-ylphenyl)ethanone
InChIKeyGAIQQJIMVVUTQN-UHFFFAOYSA-N
INCHI1S/C11H10N2O/c1-9(14)10-2-4-11(5-3-10)13-7-6-12-8-13/h2-8H,1H3
Isomeric SMILES CC(=O)C1=CC=C(C=C1)N2C=CN=C2
WGK Germany 3
NSC Number C11H10N2O
Molecular Weight 186.21
Reaxy-Rn 608955
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=608955&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
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Aryl ketones - Phenylketones
Direct ParentAlkyl-phenylketones
Alternative Parents Phenylimidazoles  Acetophenones  Benzoyl derivatives  Aryl alkyl ketones  N-substituted imidazoles  Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Alkyl-phenylketone - 1-phenylimidazole - Acetophenone - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - 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





Associated Targets(Human)
CYP3A4 Tclin Cytochrome P450 3A4 (2 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HSP90AA1 Tchem Heat shock protein HSP 90-alpha (4115 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HEK293 (82097 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
FTL Ferritin light chain (43324 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.

4 results found

Lot NumberCertificate TypeDateItem
D2315725Certificate of AnalysisJan 21, 2026 I165364
I2130297Certificate of AnalysisJul 12, 2024 I165364
I2130298Certificate of AnalysisJul 12, 2024 I165364
I2130299Certificate of AnalysisJul 12, 2024 I165364
Chemical and Physical Properties
Melt Point(°C)108-110℃(lit.)
Molecular Weight186.210 g/mol
XLogP31.400
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
Reviews

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