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2-Chloro-1-(1-chlorocyclopropyl)ethanone - 95%, high purity , CAS No.120983-72-4

COA

Grade & Purity:

≥95%

Cas Number: 120983-72-4
Molecular Weight: 153
EC Number: ‘672-784-8
PubChem CID: 11062580

In stock

Item Number

C586604

Grouped product items
SKU	Size	Availability	Price	Qty
C586604-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$271.90

Basic Description

Synonyms	Ethanone, 2-chloro-1-(1-chlorocyclopropyl)- \| Ethanone, 2-chloro-1-(1-chlorocyclopropyl)- (9CI) \| AKOS006286619 \| D88098 \| 2-chloro-1-(1-chlorocyclopropyl)ethan-1-one \| MFCD07779448 \| AC-31197 \| SCHEMBL2013537 \| VHHGLRZRRBYTNE-UHFFFAOYSA-N \| Z1198174332 \|
Specifications & Purity	≥95%
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	Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Alpha-chloroketone - 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-chloro-1-(1-chlorocyclopropyl)ethanone
INCHI	InChI=1S/C5H6Cl2O/c6-3-4(8)5(7)1-2-5/h1-3H2
InChIKey	VHHGLRZRRBYTNE-UHFFFAOYSA-N
Smiles	C1CC1(C(=O)CCl)Cl
Isomeric SMILES	C1CC1(C(=O)CCl)Cl
Molecular Weight	153
Reaxy-Rn	13463817
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13463817&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	153.000 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	151.98 Da
Monoisotopic Mass	151.98 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	118.000
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

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