2,3-Pentanedione - ≥98% , CAS No.600-14-6

CAS: 600-14-6 Cat. No.: P106293 분자식: C5H8O2 분자량: 100.12 Beilstein Registry Number: 1699638 EC 번호: 209-984-8
주문 가능
GRADE & PURITY ≥98%
Synonyms
EN300-39756 | Pentan-2,3-dione | CH3C(O)C(O)C2H5 | FT-0609761 | 2,3-Pentanedione, natural, >=96%, FG | AKOS009156847 | CCRIS 2946 | InChI=1/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H | 2,3-Pentanedione, >=96%, FCC, FG | BRN 1699638 | HY-W012998 | MFCD00009313 | 23-P
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
5ml
P106293-5ml
1 재고 있음
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US$9.90
25ml
P106293-25ml
5 재고 있음
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US$16.90
100ml
P106293-100ml
3 재고 있음
—
US$39.90
500ml
P106293-500ml
1 재고 있음
—
US$141.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

Store at 2-8°C,Argon charged 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 20 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

개요

application:

2,3-Pentanedione can be used as a reactant to synthesize:

Bisphenol derivatives by acid-catalyzed condensation reaction with phenols.

2-Ethyl-3-methyl-1H-indole by Pd-catalyzed reaction with aniline under reductive conditions.

2-Ethyl-3-methylquinoxaline by condensation reaction with o-phenylenediamine using citric acid as a catalyst.

Specifications

동의어
EN300-39756 | Pentan-2,3-dione | CH3C(O)C(O)C2H5 | FT-0609761 | 2,3-Pentanedione, natural, >=96%, FG | AKOS009156847 | CCRIS 2946 | InChI=1/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H | 2,3-Pentanedione, >=96%, FCC, FG | BRN 1699638 | HY-W012998 | MFCD00009313 | 23-P
사양 및 순도
≥98%
보관 조건
Store at 2-8°C,Argon charged
배송
Wet ice
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
순수함
≥98%
이름과 식별자
Pubchem Sid504752188
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752188
정식 스마일CCC(=O)C(=O)C
IUPAC Namepentane-2,3-dione
InChIKeyTZMFJUDUGYTVRY-UHFFFAOYSA-N
INCHI1S/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H3
이성체 SMILES CCC(=O)C(=O)C
WGK 독일 1
RTECS SA1850000
UN 번호 1224
분자량 100.12
Beilstein 1699638
Reaxy-Rn 1699638
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1699638&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
분류Organooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones
Direct ParentAlpha-diketones
Alternative Parents Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alpha-diketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
설명This compound belongs to the class of organic compounds known as alpha-diketones. These are organic compounds containing two ketone groups on two adjacent carbon atoms.
External Descriptors a small molecule
3D 구조
상호 작용 화학 구조 모델





관련 대상(인간)
ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BCHE Tclin Butyrylcholinesterase (7174 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CES2 Tchem Carboxylesterase 2 (583 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CES1 Tchem Acyl coenzyme A:cholesterol acyltransferase (1029 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
관련 대상(비인간)
Salmonella typhimurium (15756 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Vibrio parahaemolyticus (473 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Staphylococcus aureus (210822 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Escherichia coli (133304 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Listeria monocytogenes (2626 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
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 Type날짜항목
H2621028Certificate of AnalysisAug 27, 2026 P106293
B2506113Certificate of AnalysisJun 04, 2022 P106293
B2627102Certificate of AnalysisJun 04, 2022 P106293
F2229519Certificate of AnalysisJun 04, 2022 P106293
F2229520Certificate of AnalysisJun 04, 2022 P106293
F2229522Certificate of AnalysisJun 04, 2022 P106293
F2229523Certificate of AnalysisJun 04, 2022 P106293
H2310026Certificate of AnalysisJun 04, 2022 P106293
화학 및 물리적 특성
용해성Soluble in water, ethanol, ether, and acetone.
감도Sensitive to air and heat
굴절률1.404
발화점(°F)66.2 °F
발화점(°C)19 °C
끓는점(°C)110-112°C
녹는점(°C)-52°C
분자량100.120 g/mol
XLogP30.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass100.052 Da
Monoisotopic Mass100.052 Da
Topological Polar Surface Area34.100 Ų
Heavy Atom Count7
Formal Charge0
Complexity94.300
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
자주 묻는 질문과 기사
Citations of This Product
참고 문헌
1. M.G. Yu, C.D. Zheng, T. Li, H.L. Song, L.J. Wang, W. Zhang, H. Sun, Q.G. Xie, S.L. Jiang.  (2023)  Comparison of aroma properties of infant formulas: Differences in key aroma compounds and their possible origins in processing.  JOURNAL OF DAIRY SCIENCE,      [PMID:37500443] [10.3168/jds.2022-22873]
2. Xiaoyan Zhao, Shirong Kang, Hao Zhang, Hua Yang, Mingyu Dou, Haitao Zhao, Dacheng Li, Jianmin Dou.  (2023)  Highly efficient binuclear cobalt-bis(4-methylthiosemicarbazone) complex co-catalyst to support Cd0.5Zn0.5S NPs for enhanced photocatalytic hydrogen evolution.  INORGANICA CHIMICA ACTA,      [PMID:] [10.1016/j.ica.2023.121497]
3. Youyou Yang, Jing Li, Jiangtao Xing, Weihai Xing, Chaohua Tang, Zhenghua Rao, Junmin Zhang.  (2022)  Untargeted Profiling and Differentiation of Volatiles in Varieties of Meat Using GC Orbitrap MS.  Foods,  11  (24): (3997).  [PMID:36553738] [10.3390/foods11243997]
4. Caixing Pan, Heping Cui, Khizar Hayat, Xiaoming Zhang, Chi-Tang Ho.  (2022)  Exogenous glutamic acid effectively involved in N-(1-deoxy-D-galulos-1-yl)-glutamic acid degradation for simultaneous improvement of both milk-like and baking flavor.  Food Bioscience,      [PMID:] [10.1016/j.fbio.2022.101697]
5. Jing Li, Youyou Yang, Chaohua Tang, Shengnan Yue, Qingyu Zhao, Fadi Li, Junmin Zhang.  (2022)  Changes in lipids and aroma compounds in intramuscular fat from Hu sheep.  FOOD CHEMISTRY,      [PMID:35413762] [10.1016/j.foodchem.2022.132611]
6. Ruilin Feng, Yanlong Qi, Shijun Liu, Long Cui, Quanquan Dai, Chenxi Bai.  (2022)  Production of renewable 1,3-pentadiene over LaPO4 via dehydration of 2,3-pentanediol derived from 2,3-pentanedione.  APPLIED CATALYSIS A-GENERAL,      [PMID:] [10.1016/j.apcata.2022.118514]
7. Ashish Trital, Weili Xue, Longgang Wang, Shengfu Chen.  (2021)  Development of an Integrated High Serum Stability Zwitterionic Polypeptide-Based Nanodrug with Both Rapid Internalization and Endocellular Drug Releasing for Efficient Targeted Chemotherapy.  LANGMUIR,      [PMID:34812041] [10.1021/acs.langmuir.1c01945]
8. Ashish Trital, Weili Xue, Shengfu Chen.  (2020)  Development of a Negative-Biased Zwitterionic Polypeptide-Based Nanodrug Vehicle for pH-Triggered Cellular Uptake and Accelerated Drug Release.  LANGMUIR,      [PMID:32551657] [10.1021/acs.langmuir.0c00166]
9. Hui Shen, Mingquan Huang, Mouming Zhao, Weizheng Sun.  (2019)  Interactions of selected ketone flavours with porcine myofibrillar proteins: The role of molecular structure of flavour compounds.  FOOD CHEMISTRY,      [PMID:31261004] [10.1016/j.foodchem.2019.125060]
10. Chuan Yuan, Huayan Liu, Zekai Zhang, Hanfeng Lu, Qiulian Zhu, Yinfei Chen.  (2015)  Alkali-metal-modified ZSM-5 zeolites for improvement of catalytic dehydration of lactic acid to acrylic acid.  CHINESE JOURNAL OF CATALYSIS,      [PMID:] [10.1016/S1872-2067(15)60970-6]
11. Yunzi Feng, Guowan Su, Haifeng Zhao, Yu Cai, Chun Cui, Dongxiao Sun-Waterhouse, Mouming Zhao.  (2014)  Characterisation of aroma profiles of commercial soy sauce by odour activity value and omission test.  FOOD CHEMISTRY,      [PMID:25148982] [10.1016/j.foodchem.2014.06.057]
12. Han Zhang, Heping Cui, Xue Xia, Shahzad Hussain, Khizar Hayat, Xiaoming Zhang, Chi-Tang Ho.  (2024)  Control Formation of Furans and Pyrazines Resulting from Dual Glycation Sites in Nα,Nε-Di(1-deoxy-d-xylulos-1-yl)lysine via Elevating Thermal Degradation Temperatures.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,      [PMID:39481093] [10.1021/acs.jafc.4c07733]
13. Jian Yang, Daoming Chen, Meifang Cao, Xueqing Qiu, Xinping Ouyang.  (2024)  Dehydration of lactic acid to prepare acrylic acid over Hβ zeolite modified by acid treatment and Rb ion-exchange.  JOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY,      [PMID:] [10.1016/j.jiec.2024.05.031]
14. Han Zhang, Heping Cui, Xue Xia, Shahzad Hussain, Khizar Hayat, Xiaoming Zhang, Chi-Tang Ho.  (2025)  Dual role of exogenous xylose in regulating pyrazines and furans formation during the thermal degradation of Nα,Nε-di(1-deoxy-d-xylulos-1-yl)lysine through temperature, reaction time, and xylose concentration control.  FOOD CHEMISTRY,      [PMID:40086376] [10.1016/j.foodchem.2025.143828]
15. Tong Zhou, Meigui Huang, Heping Cui, Pusen Chen, Khizar Hayat, Xiaoming Zhang, Chi-Tang Ho.  (2024)  Exogenous Alanine Promoting the Reaction between Amadori Compound and Deoxyxylosone and Inhibiting the Formation of 2-Furfural during Thermal Treatment.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,      [PMID:38462902] [10.1021/acs.jafc.4c00021]
16. Mengmeng Ji, Yi Chen, Yufei Hu, Gongke Li.  (2024)  Rapid differentiation of coffee bean origin by ketones-based cyclic cataluminescence method.  TALANTA,      [PMID:39613488] [10.1016/j.talanta.2024.127261]
17. Yuanyuan Huang, Yu Sun, Arshad Mehmood, Tingting Lu, Xiumin Chen.  (2024)  Unraveling the temporal changes of Maillard reaction products and aroma profile in coffee leaves during hot-air drying.  JOURNAL OF FOOD COMPOSITION AND ANALYSIS,      [PMID:] [10.1016/j.jfca.2024.106055]
18. Yunzi Feng, Yu Cai, Guowan Su, Haifeng Zhao, Chenxia Wang, Mouming Zhao.  (2013)  Evaluation of aroma differences between high-salt liquid-state fermentation and low-salt solid-state fermentation soy sauces from China.  FOOD CHEMISTRY,      [PMID:24128458] [10.1016/j.foodchem.2013.07.072]
19. Tan Linzhi, Li Lin, Chu Fuyu, Huang Yiqun, Lai Keqiang.  (2025)  Protein deterioration and α-dicarbonyls in precooked fish during storage and reheating affected by the severity of precooking treatments.  Journal of Food Measurement and Characterization,      [PMID:] [10.1007/s11694-025-03324-4]
20. Pingyang Li, Yiyu Yin, Shijie Fan, Longzhu Zhou, Huihui Tian, Lupei Zhang, Jing Li, Kehan Ma, Junwei Hu, Yanan Yu, Qingyu Zhao, Youyou Yang, Yahui Wang, Ruiqi Peng, Yanxiang Zhang, Xuemei Gao, Yuchang Qin, Junmin Zhang, Chaohua Tang.  (2025)  Multi-omics Analysis of Lipids and Aroma Compounds in Beef under Grain-fed and Grass-fed Production Methods.  Current Research in Food Science,      [PMID:41140574] [10.1016/j.crfs.2025.101216]
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