2,6-Dimethoxy-4-methylphenol - ≥97%(GC) , CAS No.6638-05-7

CAS: 6638-05-7 Cat. No.: D155325 Formula: C₉H₁₂O₃ Peso molecolare: 168.19 Numero EC: 229-641-6

QUALITÀ & PUREZZA ≥97%(GC)

Synonyms

4-Methyl-2,6-dimethoxyphenol | Q27278026 | 1-(4,4-Diphenyl-but-3-enyl)-piperidine-3-carboxylic acid; hydrochloride | 2,6-Dimethoxy-4-methylphenol | 2,6-dimethoxy-4-methyl-phenol | AS-17263 | CGA-184927 | EINECS 229-641-6 | A840209 | DTXSID10216599 | W-104

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifiche

Sinonimi

4-Methyl-2,6-dimethoxyphenol | Q27278026 | 1-(4,4-Diphenyl-but-3-enyl)-piperidine-3-carboxylic acid; hydrochloride | 2,6-Dimethoxy-4-methylphenol | 2,6-dimethoxy-4-methyl-phenol | AS-17263 | CGA-184927 | EINECS 229-641-6 | A840209 | DTXSID10216599 | W-104

Specifiche e purezza

≥97%(GC)

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

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Purezza

≥97%(GC)

Nomi e identificatori

Pubchem Sid

504758045

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758045

Sorrisi canonici

CC1=CC(=C(C(=C1)OC)O)OC

IUPAC Name

2,6-dimethoxy-4-methylphenol

InChIKey

ZFBNNSOJNZBLLS-UHFFFAOYSA-N

INCHI

1S/C9H12O3/c1-6-4-7(11-2)9(10)8(5-6)12-3/h4-5,10H,1-3H3

Isomeri SMILES

CC1=CC(=C(C(=C1)OC)O)OC

Peso molecolare

168.19

Reaxy-Rn

1947612

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1947612&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenols
• Subclass: Methoxyphenols
• Intermediate Tree Nodes: Not available
• Direct Parent: Methoxyphenols
• Alternative Parents: Dimethoxybenzenes Phenoxy compounds Para cresols Anisoles Toluenes Alkyl aryl ethers Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Methoxyphenol - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Phenoxy compound - P-cresol - Phenol ether - Methoxybenzene - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Ether - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as methoxyphenols. These are compounds containing a methoxy group attached to the benzene ring of a phenol moiety.
• 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

Obiettivi associati (non umani)

Pseudomonas aeruginosa (123386 Activities)

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Acinetobacter baumannii (41033 Activities)

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L1210 (27553 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Slightly soluble in water.
• Sensibilità: Air Sensitive
• Punto di infiammabilità (°F): 230°F
• Punto di infiammabilità (°C): >110°C
• Punto di ebollizione (°C): 150 °C/15 mmHg
• Punto di fusione (°C): 42 °C
• Peso molecolare: 168.190 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 168.079 Da
• Monoisotopic Mass: 168.079 Da
• Topological Polar Surface Area: 38.700 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 124.000
• 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