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3-Chloro-3′,5′-dimethylbenzophenone - 98%, high purity , CAS No.844884-98-6

COA

Grade & Purity:

≥98%

Cas Number: 844884-98-6
Molecular Weight: 244.72
PubChem CID: 2757481
PubChem SID: 488193069

In stock

Item Number

C353694

Grouped product items
SKU	Size	Availability	Price
C353694-250mg	250mg	5	$186.90
C353694-1g	1g	5	$574.90
C353694-5g	5g	4	$2,210.90

Basic Description

Synonyms	MFCD06201492 \| DTXSID90373912 \| (3-Chloro-phenyl)-(3,5-dimethyl-phenyl)-methanone \| (3-chlorophenyl)-(3,5-dimethylphenyl)methanone \| 3-Chloro-3',5'-dimethylbenzophenone \| AKOS005937608
Specifications & Purity	≥98%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzophenones

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzophenones
Intermediate Tree Nodes	Not available
Direct Parent	Benzophenones
Alternative Parents	Diphenylmethanes Aryl-phenylketones m-Xylenes Benzoyl derivatives Chlorobenzenes Aryl chlorides Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzophenone - Aryl-phenylketone - Diphenylmethane - M-xylene - Xylene - Aryl ketone - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Ketone - Organic oxygen compound - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
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

Pubchem Sid	488193069
IUPAC Name	(3-chlorophenyl)-(3,5-dimethylphenyl)methanone
INCHI	InChI=1S/C15H13ClO/c1-10-6-11(2)8-13(7-10)15(17)12-4-3-5-14(16)9-12/h3-9H,1-2H3
InChIKey	OCPWBOXLLXYQCF-UHFFFAOYSA-N
Smiles	CC1=CC(=CC(=C1)C(=O)C2=CC(=CC=C2)Cl)C
Isomeric SMILES	CC1=CC(=CC(=C1)C(=O)C2=CC(=CC=C2)Cl)C
PubChem CID	2757481
Molecular Weight	244.72

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.

7 results found

Lot Number	Certificate Type	Date	Item
D2301101	Certificate of Analysis	Feb 04, 2023	C353694
D2301160	Certificate of Analysis	Feb 04, 2023	C353694
D2301151	Certificate of Analysis	Feb 04, 2023	C353694
D2301150	Certificate of Analysis	Feb 04, 2023	C353694
C2521308	Certificate of Analysis	Feb 04, 2023	C353694
D2301104	Certificate of Analysis	Feb 04, 2023	C353694
D2301122	Certificate of Analysis	Feb 04, 2023	C353694

Chemical and Physical Properties

Refractive Index	n20D1.58 (Predicted)
Boil Point(°C)	~384.6° C at 760 mmHg (Predicted)
Melt Point(°C)	111.19° C (Predicted)
Molecular Weight	244.710 g/mol
XLogP3	4.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	244.065 Da
Monoisotopic Mass	244.065 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	266.000
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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