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2，3-Dimethoxy-5-methylbenzene-1，4-diol - ≥98%, high purity , CAS No.3066-90-8

COA

Grade & Purity:

≥98%

Cas Number: 3066-90-8
Molecular Weight: 184.191
PubChem CID: 11183027

In stock

Item Number

D725663

Grouped product items
SKU	Size	Availability	Price	Qty
D725663-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$478.90

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Prenol lipids
    - Subclass Quinone and hydroquinone lipids
      - Level5 Prenylated hydroquinones
        Level6 Ubiquinols

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Prenol lipids
Subclass	Quinone and hydroquinone lipids
Intermediate Tree Nodes	Prenylated hydroquinones
Direct Parent	Ubiquinols
Alternative Parents	Methoxyphenols Dimethoxybenzenes Phenoxy compounds Ortho cresols Meta cresols Hydroquinones Anisoles Toluenes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Ubiquinol skeleton - Methoxyphenol - Dimethoxybenzene - O-dimethoxybenzene - Anisole - Hydroquinone - M-cresol - Phenoxy compound - O-cresol - Phenol ether - Methoxybenzene - Alkyl aryl ether - Phenol - Toluene - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Ether - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as ubiquinols. These are coenzyme Q derivatives containing a 5, 6-dimethoxy-3-methylbenzene-1,4-diol moiety to which an isoprenyl group is attached at ring position 2(or 6).
External Descriptors	ubiquinol
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

IUPAC Name	2,3-dimethoxy-5-methylbenzene-1,4-diol
INCHI	InChI=1S/C9H12O4/c1-5-4-6(10)8(12-2)9(13-3)7(5)11/h4,10-11H,1-3H3
InChIKey	DSBZYDDWLLIJJS-UHFFFAOYSA-N
Smiles	CC1=CC(=C(C(=C1O)OC)OC)O
Isomeric SMILES	CC1=CC(=C(C(=C1O)OC)OC)O
PubChem CID	11183027
Molecular Weight	184.191

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	184.190 g/mol
XLogP3	1.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	184.074 Da
Monoisotopic Mass	184.074 Da
Topological Polar Surface Area	58.900 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	162.000
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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