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2',3',4'-Trimethoxyacetophenone - >97.0%(GC), high purity , CAS No.13909-73-4

COA

Grade & Purity:

≥97%(GC)

Cas Number: 13909-73-4
Molecular Weight: 210.23
Beilstein Registry Number: 8393
MDL number: MFCD00008726
PubChem CID: 83810
PubChem SID: 488186213

In stock

Item Number

T162133

Grouped product items
SKU	Size	Availability	Price
T162133-1g	1g	1	$20.90
T162133-5g	5g	6	$80.90
T162133-10g	10g	2	$145.90
T162133-25g	25g	2	$327.90
T162133-100g	100g	1	$1,177.90

View related series

ketone (798) Non heterocyclic block (8163)

Basic Description

Synonyms	2',3',4'-Trimethoxyacetophenone \| 2,3,4-Trimethoxyacetophenone \| Ethanone,1-(2,3,4-trimethoxyphenyl)- \| J-640257 \| MFCD00008726 \| T1517 \| 2',3', 4'-trimethoxyacetophenone \| AC-10541 \| STL166135 \| TRI-O-METHYLGALLACETOPHENONE \| BBL013475 \| DS-17908 \| NSC68
Specifications & Purity	≥97%(GC)
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 Phenoxy compounds Methoxybenzenes Benzoyl derivatives Aryl alkyl ketones Anisoles Alkyl aryl ethers Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Alkyl-phenylketone - Acetophenone - Phenoxy compound - Methoxybenzene - Aryl alkyl ketone - Phenol ether - Benzoyl - Anisole - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Ether - Organic oxide - Hydrocarbon derivative - 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	488186213
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488186213
IUPAC Name	1-(2,3,4-trimethoxyphenyl)ethanone
INCHI	InChI=1S/C11H14O4/c1-7(12)8-5-6-9(13-2)11(15-4)10(8)14-3/h5-6H,1-4H3
InChIKey	PKNAATJMQOUREZ-UHFFFAOYSA-N
Smiles	CC(=O)C1=C(C(=C(C=C1)OC)OC)OC
Isomeric SMILES	CC(=O)C1=C(C(=C(C=C1)OC)OC)OC
WGK Germany	3
RTECS	AN0531000
PubChem CID	83810
Molecular Weight	210.23
Beilstein	8393
Reaxy-Rn	2052199

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

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

Analytical Chart:

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14 results found

Lot Number	Certificate Type	Date	Item
E23261169	Certificate of Analysis	Apr 17, 2023	T162133
E23261159	Certificate of Analysis	Apr 17, 2023	T162133
E23261110	Certificate of Analysis	Apr 17, 2023	T162133
E23261155	Certificate of Analysis	Apr 17, 2023	T162133
E1917026	Certificate of Analysis	Mar 08, 2023	T162133
C23241107	Certificate of Analysis	Jan 10, 2023	T162133
C23241110	Certificate of Analysis	Jan 10, 2023	T162133
C23241100	Certificate of Analysis	Jan 10, 2023	T162133
C23241111	Certificate of Analysis	Jan 10, 2023	T162133
C23241113	Certificate of Analysis	Jan 10, 2023	T162133
C23241114	Certificate of Analysis	Jan 10, 2023	T162133
C23241108	Certificate of Analysis	Jan 10, 2023	T162133
C23241109	Certificate of Analysis	Jan 10, 2023	T162133
C23241103	Certificate of Analysis	Jan 10, 2023	T162133

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Chemical and Physical Properties

Refractive Index	1.54
Flash Point(°F)	>235.4 °F
Flash Point(°C)	>113 °C
Boil Point(°C)	175 °C/20 mmHg
Molecular Weight	210.230 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	210.089 Da
Monoisotopic Mass	210.089 Da
Topological Polar Surface Area	44.800 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	217.000
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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