1,3-Cyclopentanedione - ≥98% , CAS No.3859-41-4

CAS: 3859-41-4 Cat. No.: C138777 Molecular Weight: 98.1 Beilstein Registry Number: 1362728 EC Number: 223-372-8
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
p-Chlorophenylhydrazine | cyclopentane-1,3-quinone | FT-0606601 | BBL011146 | NSC364015 | NSC-364015 | AKOS000278923 | 1.3-CYCLOPENTANEDIONE | F0001-1098 | malonic acid monoethyl ester | AM20100026 | AB01329887-02 | AC-1796 | CHEBI:41456 | CEJ | 1,3-cyclo
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
C138777-1g
2

$9.90

$14.90
Save $5.00 (33.56%)
5g
C138777-5g
3

$14.90

$22.90
Save $8.00 (34.93%)
10g
C138777-10g
2

$19.90

$29.90
Save $10.00 (33.44%)
25g
C138777-25g
2

$46.90

$70.90
Save $24.00 (33.85%)
100g
C138777-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$181.90

$272.90
Save $91.00 (33.35%)
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Why this grade

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

🌡

Storage & shipping

Store at 2-8°C 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.

Overview

It was used in the synthesis of chemical probes for selective labeling of sulfenic acid proteins.

Specifications

Synonyms
p-Chlorophenylhydrazine | cyclopentane-1, 3-quinone | FT-0606601 | BBL011146 | NSC364015 | NSC-364015 | AKOS000278923 | 1.3-CYCLOPENTANEDIONE | F0001-1098 | malonic acid monoethyl ester | AM20100026 | AB01329887-02 | AC-1796 | CHEBI:41456 | CEJ | 1, 3-cyclo
Specifications & Purity
≥98%
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%
Names and Identifiers
Pubchem Sid504755181
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504755181
Canonical SmilesC1CC(=O)CC1=O
IUPAC Namecyclopentane-1,3-dione
InChIKeyLOGSONSNCYTHPS-UHFFFAOYSA-N
INCHI1S/C5H6O2/c6-4-1-2-5(7)3-4/h1-3H2
Isomeric SMILES C1CC(=O)CC1=O
WGK Germany 3
Molecular Weight 98.1
Beilstein 1362728
Reaxy-Rn 1362728
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1362728&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

3D Structure
Interactive Chemical Structure Model





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.

13 results found

Lot NumberCertificate TypeDateItem
D2608010Certificate of AnalysisApr 11, 2026 C138777
J2310567Certificate of AnalysisJul 10, 2025 C138777
J2310570Certificate of AnalysisJul 10, 2025 C138777
J2310572Certificate of AnalysisJul 10, 2025 C138777
J2310573Certificate of AnalysisJul 10, 2025 C138777
J2310574Certificate of AnalysisJul 10, 2025 C138777
J2310580Certificate of AnalysisJul 10, 2025 C138777
K2120320Certificate of AnalysisSep 18, 2023 C138777
K2120325Certificate of AnalysisSep 18, 2023 C138777
I1712021Certificate of AnalysisMar 17, 2023 C138777
C2126180Certificate of AnalysisJan 12, 2023 C138777
C2126178Certificate of AnalysisJan 12, 2023 C138777
C2126179Certificate of AnalysisJan 12, 2023 C138777

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Chemical and Physical Properties
SolubilityVery soluble in water.
Melt Point(°C)149-151 °C
Molecular Weight98.100 g/mol
XLogP3-0.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass98.0368 Da
Monoisotopic Mass98.0368 Da
Topological Polar Surface Area34.100 Ų
Heavy Atom Count7
Formal Charge0
Complexity101.000
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
Documents & Articles
Solution Calculators
Reviews

Customer Reviews

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