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6'-Methoxy-2'-acetonaphthone - 98%, high purity , CAS No.3900-45-6

1 Citations

COA

Grade & Purity:

≥98%

Cas Number: 3900-45-6
Molecular Weight: 200.23
Beilstein Registry Number: 8(4)1178
EC Number: 223-453-8
MDL number: MFCD00021643
PubChem CID: 77506
PubChem SID: 488185412

In stock

Item Number

M113964

Grouped product items
SKU	Size	Availability	Price
M113964-5g	5g	4	$15.90
M113964-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$59.90
M113964-100g	100g	1	$135.90
M113964-500g	500g	1	$340.90

View related series

ketone (798) Non heterocyclic block (8163)

Basic Description

Synonyms	1-(6-Methoxy-2-naphthyl)ethanone # \| 1-(6-Methoxy-2-naphthalenyl)ethanone; 6-Methoxy-2-naphthyl Methyl Ketone; 6'-Methoxy-2'-acetonaphthone; 2-Acetyl-6-methoxynaphthalene; 6-Acetyl-2-methoxynaphthalene \| EINECS 223-453-8 \| FS-3053 \| FT-0621181 \| 6-METHOXY
Specifications & Purity	≥98%
Shipped In	Normal
Product Description	Product Description： 6′-Methoxy-2′-acetonaphthone (6-methoxy-2-naphthylacetic acid ) is metabolite of nabumetone, a phototoxic nonsteroidal antiinflammatory drug.1 6′-Methoxy-2′-acetonaphthone is suitable for use in the synthesis of 6-methoxy-2-naphthylacetic acid.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Naphthalenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Naphthalenes
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Naphthalenes
Alternative Parents	Acetophenones Aryl alkyl ketones Anisoles Alkyl aryl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Naphthalene - Acetophenone - Aryl alkyl ketone - Aryl ketone - Anisole - Alkyl aryl ether - Ketone - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
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	488185412
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488185412
IUPAC Name	1-(6-methoxynaphthalen-2-yl)ethanone
INCHI	InChI=1S/C13H12O2/c1-9(14)10-3-4-12-8-13(15-2)6-5-11(12)7-10/h3-8H,1-2H3
InChIKey	GGWCZBGAIGGTDA-UHFFFAOYSA-N
Smiles	CC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC
Isomeric SMILES	CC(=O)C1=CC2=C(C=C1)C=C(C=C2)OC
WGK Germany	3
Molecular Weight	200.23
Beilstein	8(4)1178
Reaxy-Rn	1871098
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1871098&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.

5 results found

Lot Number	Certificate Type	Date	Item
D1327022	Certificate of Analysis	Jan 07, 2025	M113964
D2412282	Certificate of Analysis	Mar 21, 2024	M113964
D2412286	Certificate of Analysis	Mar 21, 2024	M113964
D2422030	Certificate of Analysis	Mar 21, 2024	M113964
C1829064	Certificate of Analysis	Jan 21, 2022	M113964

Chemical and Physical Properties

Solubility	Soluble in Toluene
Boil Point(°C)	195°C/12mmHg
Melt Point(°C)	106-108°C
Molecular Weight	200.230 g/mol
XLogP3	3.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	200.084 Da
Monoisotopic Mass	200.084 Da
Topological Polar Surface Area	26.300 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	237.000
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

Citations of This Product

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