Trimethylhydroquinone - ≥97% , CAS No.700-13-0

CAS: 700-13-0 Cat. No.: T106610 Formula: C₉H₁₂O₂ Peso molecolare: 152.19 Beilstein Registry Number: 1909183 Numero EC: 211-838-3 PubChem CID: 12785

QUALITÀ & PUREZZA ≥97%

Synonyms

1, 2,3,5-trimethyl-|Trimethylhydroquinone|trimethyl-hydroquinone|.psi.-Cumohydroquinone|2,3,5-Trimethyl-1,4-benzenediol|2,5-Trimethyl-1,4-benzenediol|2,5,6-trimethylhydroquinone|2,6-Trimethylhydroquinone|2,3,5-Trimethylquinol|trimethyihydroquinone|psi-Cumohydroquinone|TMHYDROP|Trimethyl hydroquinone|2,3,5-Trimethyl-benzene-1,4-diol|2,3,5-trimethylbenzene-1,4-diol|2,3,5-Trimethylhydroquinone|Pseudocumohydroquinone|1,4-Benzenediol, 2,3,5-trimethyl-|HYDROQUINONE, TRIMETHYL-|1,4-Dihydroxy-2,3,5-trimethylbenzene|2,3,5-trimethyl hydroquinone|2,5-Trimethylhydroquinone

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifiche

Sinonimi

1, 2,3,5-trimethyl- | Trimethylhydroquinone | trimethyl-hydroquinone | .psi.-Cumohydroquinone | 2,3,5-Trimethyl-1,4-benzenediol | 2,5-Trimethyl-1,4-benzenediol | 2,5,6-trimethylhydroquinone | 2,6-Trimethylhydroquinone | 2,3,5-Trimethylquinol | trimethyihydroquinone | psi-Cumohydroquinone | TMHYDROP | Trimethyl hydroquinone | 2,3,5-Trimeth Mostra altro

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature,Argon charged

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

488181738

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181738

Sorrisi canonici

CC1=CC(=C(C(=C1O)C)C)O

IUPAC Name

2,3,5-trimethylbenzene-1,4-diol

InChIKey

AUFZRCJENRSRLY-UHFFFAOYSA-N

INCHI

1S/C9H12O2/c1-5-4-8(10)6(2)7(3)9(5)11/h4,10-11H,1-3H3

Isomeri SMILES

CC1=CC(=C(C(=C1O)C)C)O

WGK Germania

2

RTECS

MX7820000

PubChem CID

12785

Numero UN

3077

Peso molecolare

152.19

Beilstein

1909183

Reaxy-Rn

1909183

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenols
      • Subclass Benzenediols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: 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
• Descrizione: 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

Data sources

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in water (2 g/L @ 20°C）
• Sensibilità: Light & air sensitive
• Punto di infiammabilità (°F): 375.8 °F
• Punto di infiammabilità (°C): 191℃
• Punto di ebollizione (°C): 295°C
• Punto di fusione (°C): 169-174°
• Peso molecolare: 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 Ų
• 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