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1,2-Diethoxybenzene - >98.0%(GC), high purity , CAS No.2050-46-6

COA

Grade & Purity:

≥98%(GC)

Cas Number: 2050-46-6
Molecular Weight: 166.22
MDL number: MFCD00015143
PubChem CID: 74904
PubChem SID: 504754886

In stock

Item Number

D155734

Grouped product items
SKU	Size	Availability	Price
D155734-5g	5g	3	$17.90
D155734-25g	25g	3	$66.90
D155734-100g	100g	3	$239.90
D155734-500g	500g	2	$1,077.90

View related series

ether (317) Non heterocyclic block (8163)

Basic Description

Synonyms	InChI=1/C10H14O2/c1-3-11-9-7-5-6-8-10(9)12-4-2/h5-8H,3-4H2,1-2H \| o-Diethoxybenzene \| AC7914 \| BRN 2046149 \| EINECS 218-089-1 \| Benzene, 1,2-diethoxy- \| DTXSID6038798 \| DTXCID4018798 \| A814613 \| AI3-24177 \| Methyl 3-indolepropionate \| 1,2-DIETHOXYBENZENE
Specifications & Purity	≥98%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenol ethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenol ethers
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenol ethers
Alternative Parents	Phenoxy compounds Alkyl aryl ethers Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504754886
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504754886
IUPAC Name	1,2-diethoxybenzene
INCHI	InChI=1S/C10H14O2/c1-3-11-9-7-5-6-8-10(9)12-4-2/h5-8H,3-4H2,1-2H3
InChIKey	QZYDOKBVZJLQCK-UHFFFAOYSA-N
Smiles	CCOC1=CC=CC=C1OCC
Isomeric SMILES	CCOC1=CC=CC=C1OCC
RTECS	CZ5580000
Molecular Weight	166.22
Reaxy-Rn	2046149
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2046149&ln=

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

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

Analytical Chart:

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9 results found

Lot Number	Certificate Type	Date	Item
H1718020	Certificate of Analysis	Mar 04, 2025	D155734
F2330141	Certificate of Analysis	Jul 05, 2023	D155734
G2215346	Certificate of Analysis	May 30, 2022	D155734
G2215276	Certificate of Analysis	May 30, 2022	D155734
F2208110	Certificate of Analysis	Mar 23, 2022	D155734
F2330138	Certificate of Analysis	Mar 23, 2022	D155734
F2208113	Certificate of Analysis	Mar 23, 2022	D155734
F2330135	Certificate of Analysis	Mar 23, 2022	D155734
F2208352	Certificate of Analysis	Mar 23, 2022	D155734

Chemical and Physical Properties

Boil Point(°C)	220 °C
Melt Point(°C)	44 °C
Molecular Weight	166.220 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	166.099 Da
Monoisotopic Mass	166.099 Da
Topological Polar Surface Area	18.500 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	100.000
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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