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1-(3-(Phenylamino)phenyl)ethanone - 97%, high purity , CAS No.23699-65-2

COA

Grade & Purity:

≥97%

Cas Number: 23699-65-2
Molecular Weight: 211.26
PubChem CID: 12160729
PubChem SID: 504766937

In stock

Item Number

P192219

Grouped product items
SKU	Size	Availability	Price
P192219-50mg	50mg	3	$17.90
P192219-250mg	250mg	3	$71.90
P192219-1g	1g	2	$192.90

Basic Description

Synonyms	1-(3-(Phenylamino)phenyl)ethanone \| 23699-65-2 \| 1-(3-anilinophenyl)ethanone \| 1-(3-Phenylamino-phenyl)-ethanone \| Ethanone, 1-[3-(phenylamino)phenyl]- \| Ethanone,1-[3-(phenylamino)phenyl]- \| 3-Nitrophenylaceticacid \| SCHEMBL5608176 \| 1-(3-phenylaminophenyl)ethanone \| DTXS
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level5 Ketones
        Level6 Aryl ketones
        Level7 Phenylketones
        Level8 Alkyl-phenylketones

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Carbonyl compounds
Intermediate Tree Nodes	Ketones - Aryl ketones - Phenylketones
Direct Parent	Alkyl-phenylketones
Alternative Parents	Acetophenones Benzoyl derivatives Aryl alkyl ketones Aniline and substituted anilines Secondary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Alkyl-phenylketone - Acetophenone - Aniline or substituted anilines - Aryl alkyl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Secondary amine - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl 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

Pubchem Sid	504766937
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504766937
IUPAC Name	1-(3-anilinophenyl)ethanone
INCHI	InChI=1S/C14H13NO/c1-11(16)12-6-5-9-14(10-12)15-13-7-3-2-4-8-13/h2-10,15H,1H3
InChIKey	ZWXDAANEJMSCEX-UHFFFAOYSA-N
Smiles	CC(=O)C1=CC(=CC=C1)NC2=CC=CC=C2
Isomeric SMILES	CC(=O)C1=CC(=CC=C1)NC2=CC=CC=C2
PubChem CID	12160729
Molecular Weight	211.26

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

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

Analytical Chart:

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2 results found

Lot Number	Certificate Type	Date	Item
L22071212	Certificate of Analysis	Dec 20, 2022	P192219
D1924121	Certificate of Analysis	Feb 16, 2022	P192219

Chemical and Physical Properties

Molecular Weight	211.260 g/mol
XLogP3	3.100
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	211.1 Da
Monoisotopic Mass	211.1 Da
Topological Polar Surface Area	29.100 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	233.000
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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