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1-Chloro-3-pentanone - 85%, high purity , CAS No.32830-97-0

COA

Grade & Purity:

≥85%

Cas Number: 32830-97-0
Molecular Weight: 120.58
Beilstein Registry Number: 1699401
EC Number: 251-247-8
PubChem CID: 96526

In stock

Item Number

C351766

Grouped product items
SKU	Size	Availability	Price	Qty
C351766-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$88.90
C351766-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$244.90

Basic Description

Synonyms	J-018898 \| NSC 78422 \| 1-Chloro-3-pentanone, technical grade, 85% \| AKOS006223728 \| DTXSID9067724 \| 3-Pentanone, 1-chloro- \| FT-0729455 \| 1-Chloropentan-3-one \| NSC78422 \| NSC-78422 \| 1-chloro-pentan-3-one \| 1-Chloro-3-pentanone, purum, >=95.0% (GC) \| 1-C
Specifications & Purity	≥85%
Storage Temp	Store at 2-8°C
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

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Not available
Direct Parent	Ketones
Alternative Parents	Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Ketone - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - 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	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	1-chloropentan-3-one
INCHI	InChI=1S/C5H9ClO/c1-2-5(7)3-4-6/h2-4H2,1H3
InChIKey	APNSUHRNUVUCIP-UHFFFAOYSA-N
Smiles	CCC(=O)CCCl
Isomeric SMILES	CCC(=O)CCCl
WGK Germany	3
Molecular Weight	120.58
Beilstein	1699401
Reaxy-Rn	1699401
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1699401&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Solubility	Insoluble in water.
Refractive Index	n20D1.44 (lit.)
Flash Point(°F)	123.8 °F
Flash Point(°C)	51 °C
Boil Point(°C)	68° C (lit.) at 20 mmHg
Melt Point(°C)	-34.70° C (Predicted)
Molecular Weight	120.580 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	120.034 Da
Monoisotopic Mass	120.034 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	61.100
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

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