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2-Chlorocyclopentanone - 95%, containing K2CO3 stabilizer, high purity , CAS No.694-28-0

COA

Grade & Purity:

≥95%
containing K2CO3 stabilizer

Cas Number: 694-28-0
Molecular Weight: 118.56
Beilstein Registry Number: 1098899
EC Number: 211-769-9
MDL number: MFCD00001410
PubChem CID: 12751

In stock

Item Number

C598656

Grouped product items
SKU	Size	Availability	Price
C598656-1g	1g	3	$30.90
C598656-5g	5g	3	$100.90
C598656-25g	25g	2	$370.90
C598656-100g	100g	2	$1,040.90

Basic Description

Synonyms	2-Chlorocyclopentanone \| 694-28-0 \| CYCLOPENTANONE, 2-CHLORO- \| 2-chlorocyclopentan-1-one \| 2-Chloro-1-cyclopentanone \| alpha-Chlorocyclopentanone \| .alpha.-Chlorocyclopentanone \| EINECS 211-769-9 \| MFCD00001410 \| NSC 60206 \| BRN 1098899 \| chlorocyclopentanone \| WLN: L5VTJ BG \| 2-
Specifications & Purity	≥95%, containing K2CO3 stabilizer
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.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level5 Ketones
        Level6 Alpha-haloketones
        Level7 Alpha-chloroketones

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Ketones - Alpha-haloketones
Direct Parent	Alpha-chloroketones
Alternative Parents	Cyclic ketones Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Alpha-chloroketone - Cyclic ketone - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as alpha-chloroketones. These are organic compounds contaning a chlorine atom attached to the alpha carbon atom relative to C=O group.
External Descriptors	Not available
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

IUPAC Name	2-chlorocyclopentan-1-one
INCHI	InChI=1S/C5H7ClO/c6-4-2-1-3-5(4)7/h4H,1-3H2
InChIKey	AXDZFGRFZOQVBV-UHFFFAOYSA-N
Smiles	C1CC(C(=O)C1)Cl
Isomeric SMILES	C1CC(C(=O)C1)Cl
WGK Germany	3
RTECS	GY4900000
UN Number	2810
Molecular Weight	118.56
Beilstein	1098899
Reaxy-Rn	1098899
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1098899&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.

4 results found

Lot Number	Certificate Type	Date	Item
G2326547	Certificate of Analysis	Aug 01, 2023	C598656
G2326545	Certificate of Analysis	Aug 01, 2023	C598656
G2326548	Certificate of Analysis	Aug 01, 2023	C598656
G2326544	Certificate of Analysis	Aug 01, 2023	C598656

Chemical and Physical Properties

Solubility	Soluble in water
Sensitivity	Moisture & Heat sensitive
Refractive Index	1.474
Flash Point(°F)	170.6 °F
Flash Point(°C)	77 °C
Boil Point(°C)	72-74°C/12mmHg
Molecular Weight	118.560 g/mol
XLogP3	1.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	118.019 Da
Monoisotopic Mass	118.019 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	90.100
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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