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3-Methyl-2-pentanone - >98.0%(GC), high purity , CAS No.565-61-7

1 Citations

COA

Grade & Purity:

≥98%(GC)

Cas Number: 565-61-7
Molecular Weight: 100.16
Beilstein Registry Number: 1693
EC Number: 209-282-1
MDL number: MFCD00009336
PubChem CID: 11262
PubChem SID: 488181292

In stock

Item Number

M158800

Grouped product items
SKU	Size	Availability	Price
M158800-5ml	5ml	≥10	$34.90
M158800-25ml	25ml	10	$131.90
M158800-100ml	100ml	2	$471.90

View related series

Carbonyl compound (2335) ketone (798) Non heterocyclic block (8163)

Basic Description

Synonyms	EN300-19776 \| Methyl 1-methylpropyl ketone \| NCGC00248679-01 \| LMFA12000027 \| sec-Butyl methyl ketone \| 3-Methyl-2-pentanone, 99% \| 3-METHYLPENTAN-2-ONE \| EC 209-282-1 \| NSC66492 \| NSC-66492 \| DTXCID801634 \| NCGC00258084-01 \| methylethylacetone \| MFCD0000
Specifications & Purity	≥98%(GC)
Shipped In	Normal

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	Ketones
Alternative Parents	Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This 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
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	488181292
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181292
IUPAC Name	3-methylpentan-2-one
INCHI	InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3
InChIKey	UIHCLUNTQKBZGK-UHFFFAOYSA-N
Smiles	CCC(C)C(=O)C
Isomeric SMILES	CCC(C)C(=O)C
WGK Germany	3
UN Number	1224
Packing Group	II
Molecular Weight	100.16
Beilstein	1693
Reaxy-Rn	635791
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635791&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.

13 results found

Lot Number	Certificate Type	Date	Item
C2524289	Certificate of Analysis	Mar 13, 2025	M158800
C2524288	Certificate of Analysis	Mar 13, 2025	M158800
C2524622	Certificate of Analysis	Mar 13, 2025	M158800
D2407410	Certificate of Analysis	Mar 26, 2024	M158800
D2407411	Certificate of Analysis	Mar 26, 2024	M158800
D2407514	Certificate of Analysis	Mar 26, 2024	M158800
K2212460	Certificate of Analysis	Nov 03, 2022	M158800
K2212476	Certificate of Analysis	Nov 03, 2022	M158800
K2212464	Certificate of Analysis	Nov 03, 2022	M158800
K2212474	Certificate of Analysis	Nov 03, 2022	M158800
K2212507	Certificate of Analysis	Nov 03, 2022	M158800
K2212674	Certificate of Analysis	Nov 03, 2022	M158800
F2330022	Certificate of Analysis	Nov 03, 2022	M158800

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Chemical and Physical Properties

Solubility	Soluble in alcohol.
Refractive Index	1.4
Flash Point(°F)	53.6 °F
Flash Point(°C)	12 °C
Boil Point(°C)	118-119℃
Molecular Weight	100.160 g/mol
XLogP3	1.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	100.089 Da
Monoisotopic Mass	100.089 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	66.600
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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