2,5-Hexanedione - Standard for GC, ≥99%(GC) , CAS No.110-13-4

CAS: 110-13-4 Cat. No.: H106697 Formula: C6H10O2 Molecular Weight: 114.14 Beilstein Registry Number: 506525 EC Number: 203-738-3
AVAILABLE TO ORDER
GRADE & PURITY Standard for GC ? GC reference standard — characterized compound for calibrating GC methods. Use to build calibration curves and verify GC quantitation. ≥99%(GC)
Synonyms
2,5-Hexadione | 2,5-Dioxohexane | alpha,beta-Diacetylethane | A802149 | Hexanedione-(2,5) | BBL027731 | InChI=1/C6H10O2/c1-5(7)3-4-6(2)8/h3-4H2,1-2H | H0101 | hexan-2,5-dione | EN300-19144 | EINECS 203-738-3 | LMFA12000081 | NCGC00258172-01 | AKOS00011900
Storage
Room temperature
Shipped In
Normal
★
Size
Germany (EU)
USA*
Price
Qty
5ml
H106697-5ml
—
2 In stock
€10.33
25ml
H106697-25ml
—
2 In stock
€35.49
100ml
H106697-100ml
—
3 In stock
€111.85
Enter a quantity for the sizes you want to add.
🧪
Why this grade

Standard for GC, ≥99%(GC) Standard for 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 18 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
2,5-Hexadione | 2,5-Dioxohexane | alpha,beta-Diacetylethane | A802149 | Hexanedione-(2,5) | BBL027731 | InChI=1/C6H10O2/c1-5(7)3-4-6(2)8/h3-4H2,1-2H | H0101 | hexan-2,5-dione | EN300-19144 | EINECS 203-738-3 | LMFA12000081 | NCGC00258172-01 | AKOS00011900
Specifications & Purity
Standard for GC, ≥99%(GC)
Storage
Room temperature
Shipped In
Normal
Grade
Standard for GC
Purity
≥99%(GC)
Names and Identifiers
Pubchem Sid528755594
Canonical SmilesCC(=O)CCC(=O)C
IUPAC Namehexane-2,5-dione
InChIKeyOJVAMHKKJGICOG-UHFFFAOYSA-N
INCHI1S/C6H10O2/c1-5(7)3-4-6(2)8/h3-4H2,1-2H3
Isomeric SMILES CC(=O)CCC(=O)C
WGK Germany 2
RTECS MO3150000
UN Number 1224
Packing Group I
Molecular Weight 114.14
Beilstein 506525
Reaxy-Rn 506525
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506525&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 Not available
Direct ParentKetones
Alternative Parents Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol.
External Descriptors Oxygenated hydrocarbons
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
Associated Targets(non-human)
Plasmodium falciparum (966862 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.

8 results found

Lot NumberCertificate TypeDateItem
C2327122Certificate of AnalysisSep 22, 2026 H106697
C2327125Certificate of AnalysisSep 22, 2026 H106697
C2327126Certificate of AnalysisSep 22, 2026 H106697
B2314410Certificate of AnalysisAug 03, 2026 H106697
B2301570Certificate of AnalysisAug 03, 2026 H106697
J1929167Certificate of AnalysisMay 09, 2023 H106697
D1902171Certificate of AnalysisNov 14, 2022 H106697
A1427010Certificate of AnalysisJan 18, 2022 H106697
Chemical and Physical Properties
SolubilityEasily soluble in water and most organic solvents.
x_refractive_index1.425
x_flash_point_drop_fahrenheit174.2 ℉
x_flash_point_drop_centigrade79 ℃
x_boil_point_char191°C
x_melt_point_char-6--5°C
Molecular Weight114.140 g/mol
XLogP3-0.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass114.068 Da
Monoisotopic Mass114.068 Da
Topological Polar Surface Area34.100 Ų
Heavy Atom Count8
Formal Charge0
Complexity91.100
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
FAQs and Articles
Citations of This Product
Solution Calculators
Reviews

Customer Reviews

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.