2-Methyl-N-phenylmaleimide - ≥98% , CAS No.3120-04-5

CAS: 3120-04-5 Cat. No.: M333677 Molecular Weight: 187.19 EC Number: 626-011-6
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
J-018278 | 3-Methyl-1-phenyl-pyrrole-2,5-dione | 3-Methyl-1-phenyl-pyrrole2,5-dione | 3-methyl-1-phenylpyrrole-2,5-dione | starbld0001226 | EU-0050672 | 3-Methylphenylmaleimide | DTXSID50351059 | PD135229 | SCHEMBL774452 | 2-Methyl-N-phenylmaleimide | 3-M
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
M333677-1g
4
$61.90
5g
M333677-5g
4
$205.90
25g
M333677-25g
1
$741.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% 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
J-018278 | 3-Methyl-1-phenyl-pyrrole-2, 5-dione | 3-Methyl-1-phenyl-pyrrole2, 5-dione | 3-methyl-1-phenylpyrrole-2, 5-dione | starbld0001226 | EU-0050672 | 3-Methylphenylmaleimide | DTXSID50351059 | PD135229 | SCHEMBL774452 | 2-Methyl-N-phenylmaleimide | 3-M
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488191149
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488191149
Canonical SmilesCC1=CC(=O)N(C1=O)C2=CC=CC=C2
IUPAC Name3-methyl-1-phenylpyrrole-2,5-dione
InChIKeyQAVUFFJVZGZJMO-UHFFFAOYSA-N
INCHI1S/C11H9NO2/c1-8-7-10(13)12(11(8)14)9-5-3-2-4-6-9/h2-7H,1H3
Isomeric SMILES CC1=CC(=O)N(C1=O)C2=CC=CC=C2
Molecular Weight 187.19
Reaxy-Rn 137271
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=137271&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.

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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
ClassPyrrolines
SubclassPhenylpyrrolines
Intermediate Tree Nodes Not available
Direct ParentPhenylpyrrolines
Alternative Parents Maleimides  N-substituted carboxylic acid imides  Benzene and substituted derivatives  Pyrroles  Dicarboximides  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 1-phenylpyrroline - Maleimide - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Carboxylic acid imide - Dicarboximide - Pyrrole - Carboxylic acid derivative - Azacycle - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NCI-H460 (60772 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SF-268 (49410 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MGLL Tchem Monoglyceride lipase (1909 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Faah Anandamide amidohydrolase (3907 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nannizzia gypsea (2039 Activities)
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Aspergillus flavus (8875 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Aspergillus niger (16508 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Saccharomyces cerevisiae (19171 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Aspergillus fumigatus (16427 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Cryptococcus neoformans (21258 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Candida albicans (78123 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Candida tropicalis (8381 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Trichophyton rubrum (3646 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.

7 results found

Lot NumberCertificate TypeDateItem
H2218641Certificate of AnalysisJun 12, 2025 M333677
H2218639Certificate of AnalysisJun 10, 2025 M333677
H2218640Certificate of AnalysisJun 10, 2025 M333677
H2218289Certificate of AnalysisJul 08, 2022 M333677
H2218296Certificate of AnalysisJul 08, 2022 M333677
H2218297Certificate of AnalysisJul 08, 2022 M333677
H2218298Certificate of AnalysisJul 08, 2022 M333677
Chemical and Physical Properties
Boil Point(°C)172° C (lit.) at 12 mmHg
Melt Point(°C)96-98° C (lit.)
Molecular Weight187.190 g/mol
XLogP31.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass187.063 Da
Monoisotopic Mass187.063 Da
Topological Polar Surface Area37.400 Ų
Heavy Atom Count14
Formal Charge0
Complexity300.000
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

Customer Reviews

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