2,4-Dimethoxy-3-methylbenzaldehyde - ≥99% , CAS No.7149-92-0

CAS: 7149-92-0 Cat. No.: D474388 Fórmula: C₁₀H₁₂O₃ Peso molecular: 180.2 Número EC: 628-374-6

GRADE & PURITY ≥99%

Synonyms

2,4-dimethoxy 3-methyl benzaldehyde | FT-0636371 | 2,4-Dimethoxy-3-methylbenzaldehyde, 99% | 2-methoxy-3-methylanisaldehyde | DTXSID50291007 | 2-chloro-9-isopropyl-N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-9H-purin-6-amine | MFCD00011489 |

Storage

Argon charged,Room temperature

Shipped In

Normal

Descripción general

Description

2,4-Dimethoxy-3-methylbenzaldehyde has been used:as starting reagent in stereocontrolled total synthesis of (−)-kendomycinin total syntheses of renierol, renierol acetate and renierol propionate

Specifications

Sinónimos

2,4-dimethoxy 3-methyl benzaldehyde | FT-0636371 | 2,4-Dimethoxy-3-methylbenzaldehyde, 99% | 2-methoxy-3-methylanisaldehyde | DTXSID50291007 | 2-chloro-9-isopropyl-N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-9H-purin-6-amine | MFCD00011489 |

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Argon charged,Room temperature

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

Pubchem Sid

488189026

Sonrisas canónicas

CC1=C(C=CC(=C1OC)C=O)OC

IUPAC Name

2,4-dimethoxy-3-methylbenzaldehyde

InChIKey

UOKAZUWUHOBBMD-UHFFFAOYSA-N

INCHI

1S/C10H12O3/c1-7-9(12-2)5-4-8(6-11)10(7)13-3/h4-6H,1-3H3

Isómeros SMILES

CC1=C(C=CC(=C1OC)C=O)OC

Peso molecular

180.2

Reaxy-Rn

1948407

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1948407&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Methoxybenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Methoxybenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Dimethoxybenzenes
• Alternative Parents: Phenoxy compounds Benzoyl derivatives Benzaldehydes Anisoles Toluenes Alkyl aryl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Dimethoxybenzene - M-dimethoxybenzene - Anisole - Benzaldehyde - Benzoyl - Phenol ether - Phenoxy compound - Toluene - Aryl-aldehyde - Alkyl aryl ether - Ether - Organooxygen compound - Aldehyde - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
• 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

Propiedades químicas y físicas

• Solubilidad: souble in Methanol
• Sensibilidad: air sensitive
• Punto de ebullición (°C): 109 °C/4 mmHg
• Punto de fusión (°C): 54 °C
• Peso molecular: 180.200 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 180.079 Da
• Monoisotopic Mass: 180.079 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 170.000
• 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

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 7149-92-0, the molecular formula is C10H12O3, and the molecular weight is 180.2 g/mol. InChIKey UOKAZUWUHOBBMD-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.