3,5-Dimethoxybenzaldehyde - ≥98%(GC) , CAS No.7311-34-4

CAS: 7311-34-4 Cat. No.: D123418 분자식: C₉H₁₀O₃ 분자량: 166.17 Beilstein Registry Number: 2042374 EC 번호: 230-772-6

GRADE & PURITY ≥98%(GC)

Synonyms

HY-W007626 | SY001676 | DTXSID50223388 | STR05637 | UNII-P82W3UJ5DT | D1164 | 3,5-Dimethoxybenzaldehyde, 98% | CL8299 | FT-0600973 | ghl.PD_Mitscher_leg0.694 | InChI=1/C9H10O3/c1-11-8-3-7(6-10)4-9(5-8)12-2/h3-6H,1-2H | L-Azidohomoalanine HCl | 3,5 dimetho

Storage

Argon charged,Room temperature

Shipped In

Normal

개요

Used frequently as synthetic building block.

Specifications

동의어

HY-W007626 | SY001676 | DTXSID50223388 | STR05637 | UNII-P82W3UJ5DT | D1164 | 3,5-Dimethoxybenzaldehyde, 98% | CL8299 | FT-0600973 | ghl.PD_Mitscher_leg0.694 | InChI=1/C9H10O3/c1-11-8-3-7(6-10)4-9(5-8)12-2/h3-6H,1-2H | L-Azidohomoalanine HCl | 3,5 dimetho

사양 및 순도

≥98%(GC)

보관 조건

Argon charged,Room temperature

배송

Normal

순수함

≥98%(GC)

이름과 식별자

• Pubchem Sid: 488186003
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186003
• 정식 스마일: COC1=CC(=CC(=C1)C=O)OC
• IUPAC Name: 3,5-dimethoxybenzaldehyde
• InChIKey: VFZRZRDOXPRTSC-UHFFFAOYSA-N
• INCHI: 1S/C9H10O3/c1-11-8-3-7(6-10)4-9(5-8)12-2/h3-6H,1-2H3
• 이성체 SMILES: COC1=CC(=CC(=C1)C=O)OC
• WGK 독일: 3
• 분자량: 166.17
• Beilstein: 2042374
• Reaxy-Rn: 2042374
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2042374&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Methoxybenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Dimethoxybenzenes
• Alternative Parents: Phenoxy compounds Benzoyl derivatives Benzaldehydes Anisoles Alkyl aryl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Dimethoxybenzene - M-dimethoxybenzene - Anisole - Benzaldehyde - Benzoyl - Phenol ether - Phenoxy compound - Aryl-aldehyde - Alkyl aryl ether - Ether - Organooxygen compound - Aldehyde - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
• 설명: 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

작용 메커니즘

화학 및 물리적 특성

• 용해성: Soluble in hot methanol. Insoluble in water.
• 감도: Air Sensitive,Vacuum or nitrogen storage
• 발화점(°F): 235.4 °F
• 발화점(°C): >110°C(230°F)
• 끓는점(°C): 151°C/16mmHg
• 녹는점(°C): 44-48°C
• 분자량: 166.170 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 166.063 Da
• Monoisotopic Mass: 166.063 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 135.000
• 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, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). 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.

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

The CAS Number is 7311-34-4, the molecular formula is C9H10O3, and the molecular weight is 166.17 g/mol. InChIKey VFZRZRDOXPRTSC-UHFFFAOYSA-N.

How is this product shipped?

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

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.