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Trimethylhydroquinone - 97%, high purity , CAS No.700-13-0

5 Citations

COA

Grade & Purity:

≥97%

Cas Number: 700-13-0
Molecular Weight: 152.19
Beilstein Registry Number: 1909183
EC Number: 211-838-3
MDL number: MFCD00002346
PubChem CID: 12785
PubChem SID: 488181738

In stock

Item Number

T106610

Grouped product items
SKU	Size	Availability	Price
T106610-25g	25g	7	$27.90
T106610-100g	100g	3	$99.90
T106610-250g	250g	3	$223.90
T106610-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$401.90

View related series

alcohol (850) Oxygenated compounds (806)

Basic Description

Synonyms	1, 2,3,5-trimethyl- \| GSY6340N4A \| UNII-GSY6340N4A \| DTXCID9031018 \| SR-01000944714-1 \| Trimethylhydroquinone \| trimethyl-hydroquinone \| CHEBI:176794 \| .psi.-Cumohydroquinone \| 2,3,5-Trimethyl-1,4-benzenediol \| Q27279264 \| NSC401617 \| NSC-401617 \| AS-1279
Specifications & Purity	≥97%
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenols
    - Subclass Benzenediols

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenols
Subclass	Benzenediols
Intermediate Tree Nodes	Not available
Direct Parent	Hydroquinones
Alternative Parents	Ortho cresols Meta cresols 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Organooxygen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	O-cresol - M-cresol - Hydroquinone - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as hydroquinones. These are compounds containing a hydroquinone moiety, which consists of a benzene ring with a hydroxyl groups at positions 1 and 4.
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	488181738
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488181738
IUPAC Name	2,3,5-trimethylbenzene-1,4-diol
INCHI	InChI=1S/C9H12O2/c1-5-4-8(10)6(2)7(3)9(5)11/h4,10-11H,1-3H3
InChIKey	AUFZRCJENRSRLY-UHFFFAOYSA-N
Smiles	CC1=CC(=C(C(=C1O)C)C)O
Isomeric SMILES	CC1=CC(=C(C(=C1O)C)C)O
WGK Germany	2
RTECS	MX7820000
PubChem CID	12785
UN Number	3077
Molecular Weight	152.19
Beilstein	1909183
Reaxy-Rn	1909183

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.

9 results found

Lot Number	Certificate Type	Date	Item
H2118127	Certificate of Analysis	Jun 09, 2025	T106610
H2118128	Certificate of Analysis	Jun 09, 2025	T106610
H2118129	Certificate of Analysis	Jun 09, 2025	T106610
H2118130	Certificate of Analysis	Jun 09, 2025	T106610
G2223003	Certificate of Analysis	Jun 12, 2022	T106610
G2222863	Certificate of Analysis	Jun 12, 2022	T106610
G2223020	Certificate of Analysis	Jun 12, 2022	T106610
G2223007	Certificate of Analysis	Jun 12, 2022	T106610
E2304286	Certificate of Analysis	Jun 07, 2021	T106610

Chemical and Physical Properties

Solubility	Soluble in water (2 g/L @ 20°C）
Sensitivity	Light & air sensitive
Flash Point(°F)	375.8 °F
Flash Point(°C)	191℃
Boil Point(°C)	295°C
Melt Point(°C)	169-174°
Molecular Weight	152.190 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	152.084 Da
Monoisotopic Mass	152.084 Da
Topological Polar Surface Area	40.500 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	136.000
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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