4-Methoxy-2-methylbenzaldehyde - ≥95% , CAS No.52289-54-0

CAS: 52289-54-0 Cat. No.: M124189 분자식: CH₃C₆H₃(OCH₃)CHO 분자량: 150.17 EC 번호: 888-099-4

등급 & 순도 ≥95%

Synonyms

4-Methoxy-2-methylbenzaldehyde | 4-Methoxy-2-Methyl-Benzaldehyde | 4-methoxy-2-methylbenzaldehyd | 2-Methyl-4-methoxybenzaldehyde | 2-Methyl-anisaldehyde | STL553953 | WICYVKGMEJSDAO-UHFFFAOYSA-N | SCHEMBL135243 | 4-Methoxy-2-methylbenzaldehyde, 95% | Z38

Storage

Room temperature,Argon charged

Shipped In

Normal

사양

동의어

4-Methoxy-2-methylbenzaldehyde | 4-Methoxy-2-Methyl-Benzaldehyde | 4-methoxy-2-methylbenzaldehyd | 2-Methyl-4-methoxybenzaldehyde | 2-Methyl-anisaldehyde | STL553953 | WICYVKGMEJSDAO-UHFFFAOYSA-N | SCHEMBL135243 | 4-Methoxy-2-methylbenzaldehyde, 95% | Z38

사양 및 순도

≥95%

보관 조건

Room temperature,Argon charged

배송

Normal

순수함

≥95%

이름과 식별자

Pubchem Sid

488189253

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488189253

정식 스마일

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

IUPAC Name

4-methoxy-2-methylbenzaldehyde

InChIKey

WICYVKGMEJSDAO-UHFFFAOYSA-N

INCHI

1S/C9H10O2/c1-7-5-9(11-2)4-3-8(7)6-10/h3-6H,1-2H3

이성체 SMILES

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

WGK 독일

3

분자량

150.17

Reaxy-Rn

1933786

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1933786&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Benzoyl derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Benzoyl derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoyl derivatives
• Alternative Parents: Phenoxy compounds Methoxybenzenes Benzaldehydes Anisoles Toluenes Alkyl aryl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Anisole - Benzaldehyde - Benzoyl - Phenol ether - Methoxybenzene - Phenoxy compound - Toluene - Aryl-aldehyde - Alkyl aryl ether - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aldehyde - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
• 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

화학 및 물리적 특성

• 굴절률: 1.571
• 발화점(°F): >230 °F
• 발화점(°C): >110 °C
• 끓는점(°C): 262-267°C
• 분자량: 150.170 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 150.068 Da
• Monoisotopic Mass: 150.068 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 134.000
• 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

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥95% 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 52289-54-0, the molecular formula is C9H10O2, and the molecular weight is 150.17 g/mol. InChIKey WICYVKGMEJSDAO-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.