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3-Hydroxy-3-methyl-2-butanone - ≥95.0%(GC), high purity , CAS No.115-22-0

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3-Hydroxy-3-methyl-2-butanone - ≥95.0%(GC), high purity , CAS No.115-22-0

4 Citations

COA

Grade & Purity:

≥95%(GC)

Cas Number: 115-22-0
Molecular Weight: 102.13
Beilstein Registry Number: 1616385
EC Number: 204-073-1
MDL number: MFCD00004460
PubChem CID: 8261
PubChem SID: 504751638

In stock

Item Number

H138057

Grouped product items
SKU	Size	Availability	Price
H138057-5ml	5ml	3	$28.90
H138057-25ml	25ml	3	$108.90
H138057-100ml	100ml	2	$323.90
H138057-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$32.90
H138057-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$119.90

View related series

ketone (798) Non heterocyclic block (8163)

Basic Description

Synonyms	2-Butanone, 3-hydroxy-3-methyl- \| NSC 5576 \| 3-Hydroxy-3-methyl-2-butanone, 95% anhydrous basis \| EINECS 204-073-1 \| 3-HYDROXY-3-METHYL-2-BUTANONE \| A855380 \| InChI=1/C5H10O2/c1-4(6)5(2,3)7/h7H,1-3H \| AKOS009157070 \| 3-methyl-3-hydroxy-2-butanone \| LMFA12
Specifications & Purity	≥95%(GC)
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	application： 3-Hydroxy-3-methyl-2-butanone used to produce 2,5-dihydroxy-2-methyl-heptan-3-one, laboratory chemicals.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Not available
Direct Parent	Acyloins
Alternative Parents	Tertiary alcohols Alpha-hydroxy ketones Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Acyloin - Tertiary alcohol - Alpha-hydroxy ketone - Ketone - Organic oxide - Hydrocarbon derivative - Alcohol - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as acyloins. These are organic compounds containing an alpha hydroxy ketone. Acyloins are formally derived from reductive coupling of carboxylic acyl groups.
External Descriptors	a small molecule
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504751638
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504751638
IUPAC Name	3-hydroxy-3-methylbutan-2-one
INCHI	InChI=1S/C5H10O2/c1-4(6)5(2,3)7/h7H,1-3H3
InChIKey	BNDRWEVUODOUDW-UHFFFAOYSA-N
Smiles	CC(=O)C(C)(C)O
Isomeric SMILES	CC(=O)C(C)(C)O
WGK Germany	3
Molecular Weight	102.13
Beilstein	1616385
Reaxy-Rn	1616385
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1616385&ln=

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.

12 results found

Lot Number	Certificate Type	Date	Item
C2517097	Certificate of Analysis	Mar 28, 2025	H138057
C2517098	Certificate of Analysis	Mar 26, 2025	H138057
C2517099	Certificate of Analysis	Mar 26, 2025	H138057
K1915245	Certificate of Analysis	Mar 04, 2025	H138057
K2208174	Certificate of Analysis	Aug 22, 2024	H138057
K2208009	Certificate of Analysis	Aug 22, 2024	H138057
K2208155	Certificate of Analysis	Aug 22, 2024	H138057
H2406249	Certificate of Analysis	Apr 26, 2024	H138057
H2406248	Certificate of Analysis	Apr 26, 2024	H138057
J2128362	Certificate of Analysis	Aug 01, 2023	H138057
J2128363	Certificate of Analysis	Aug 01, 2023	H138057
J2128364	Certificate of Analysis	Aug 01, 2023	H138057

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Chemical and Physical Properties

Solubility	Soluble in chloroform.
Sensitivity	Heat & Air sensitive.
Refractive Index	1.415
Flash Point(°F)	107.6 °F
Flash Point(°C)	42 °C
Boil Point(°C)	138 °C
Melt Point(°C)	140-141℃
Molecular Weight	102.130 g/mol
XLogP3	-0.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	102.068 Da
Monoisotopic Mass	102.068 Da
Topological Polar Surface Area	37.300 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	84.100
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Siyuan Li, Xianrong Yu, Linlin Zeng, Yuhan Xu, Xiaolan Zhao, Wei Tang, Xinrui Duan. (2022) A Sensitive Fluorescent Probe with Large Stokes Shift for Real-Time Tracking Lysosomal pH Changes in Live Cells. ChemistrySelect, 7 (42): (e202202620).
2. Ya-Li Meng, Zhen-Hui Xin, Yu-Jie Jia, Yan-Fei Kang, Li-Ping Ge, Cun-Hui Zhang, Ming-Yan Dai. (2018) A near-infrared fluorescent probe for direct and selective detection of cysteine over homocysteine and glutathione. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 202 (301).
3. Duozhen Chai, Chongli Wang, Jinzhen Liu, Dongfeng Cao, Kaixuan Guo, Yuankun Wang, Ye Yuan, Francis Verpoort. (2025) CuCl/Ionic Liquid Catalyzed Cascade Transformation of CO2 and Alkyne-1,2-Diols: Synthesis of Keto-Functionalized Cyclic Carbonates. Catalysts, 15 (3): (279).
4. Zhenzhen Cai, Zhiheng Huo, Gaosheng Li, Xu Cheng, Fang Xiao, Yuwan Du, Baiyi Zu, Xincun Dou. (2025) Precise Electron-Withdrawing Strength Regulation of π-Conjugate Bridge-Boosted Specific Detection toward α-Methyltryptamine. ANALYTICAL CHEMISTRY, 97 (4): (2418-2427).

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