N-Allyloxyphthalimide - ≥98%(GC) , CAS No.39020-79-6

CAS: 39020-79-6 Cat. No.: N159661 Molecular Weight: 203.2 Beilstein Registry Number: 21(5)11,101 EC Number: 672-772-2
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(GC)
Synonyms
SB64067 | DTXSID00377542 | XVKREICBUWCANY-UHFFFAOYSA-N | 2-allyloxy-isoindole-1,3-dione | HMS2165N05 | 2-(prop-2-en-1-yloxy)-2,3-dihydro-1H-isoindole-1,3-dione | FT-0639511 | MLS000539864 | SCHEMBL1715729 | STK407694 | 2-prop-2-enoxyisoindole-1,3-dione |
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5g
N159661-5g
1

$33.90

$50.90
Save $17.00 (33.40%)
25g
N159661-25g
1

$168.90

$253.90
Save $85.00 (33.48%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(GC) 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
SB64067 | DTXSID00377542 | XVKREICBUWCANY-UHFFFAOYSA-N | 2-allyloxy-isoindole-1, 3-dione | HMS2165N05 | 2-(prop-2-en-1-yloxy)-2, 3-dihydro-1H-isoindole-1, 3-dione | FT-0639511 | MLS000539864 | SCHEMBL1715729 | STK407694 | 2-prop-2-enoxyisoindole-1, 3-dione |
Specifications & Purity
≥98%(GC)
Storage
Room temperature
Shipped In
Normal
Purity
≥98%(GC)
Names and Identifiers
Pubchem Sid488193401
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488193401
Canonical SmilesC=CCON1C(=O)C2=CC=CC=C2C1=O
IUPAC Name2-prop-2-enoxyisoindole-1,3-dione
InChIKeyXVKREICBUWCANY-UHFFFAOYSA-N
INCHI1S/C11H9NO3/c1-2-7-15-12-10(13)8-5-3-4-6-9(8)11(12)14/h2-6H,1,7H2
Isomeric SMILES C=CCON1C(=O)C2=CC=CC=C2C1=O
Molecular Weight 203.2
Beilstein 21(5)11,101
Reaxy-Rn 1530729
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1530729&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.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassIsoindoles and derivatives
SubclassIsoindolines
Intermediate Tree Nodes Isoindolones
Direct ParentPhthalimides
Alternative Parents Isoindoles  Benzenoids  Carboxylic acids and derivatives  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Phthalimide - Isoindole - Benzenoid - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phthalimides. These are aromatic heterocyclic compounds containing a 1,3-dioxoisoindoline moiety. They are imide derivatives of phthalic anhydrides.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 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
SMAD3 Tchem Mothers against decapentaplegic homolog 3 (68039 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CBX1 Tbio Chromobox protein homolog 1 (92434 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.

6 results found

Lot NumberCertificate TypeDateItem
L2523129Certificate of AnalysisDec 29, 2025 N159661
E1718024Certificate of AnalysisJan 07, 2025 N159661
K2229437Certificate of AnalysisOct 10, 2022 N159661
K2229440Certificate of AnalysisOct 10, 2022 N159661
K2229441Certificate of AnalysisOct 10, 2022 N159661
K2229442Certificate of AnalysisOct 10, 2022 N159661
Chemical and Physical Properties
Melt Point(°C)60 °C
Molecular Weight203.190 g/mol
XLogP32.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass203.058 Da
Monoisotopic Mass203.058 Da
Topological Polar Surface Area46.600 Ų
Heavy Atom Count15
Formal Charge0
Complexity276.000
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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