6-Methylchromone - ≥98% , CAS No.38445-23-7

CAS: 38445-23-7 Cat. No.: M158437 분자식: C₁₀H₈O₂ 분자량: 160.17 EC 번호: 670-394-2

GRADE & PURITY ≥98%

Synonyms

M2764 | Chromone, 6-methyl- | SCHEMBL932337 | 6-METHYLCHROMONE | METHYLBROMODICHLOROACETATE | AKOS000275965 | D76209 | MFCD00218598 | 6-methylchromen-4-one | 6-Methyl-4-oxo-4H-1-benzopyran | 6-Methylchromone, AldrichCPR | 6-Methyl-4H-chromen-4-one # | 6-M

Storage

Room temperature

Shipped In

Normal

Specifications

동의어

M2764 | Chromone, 6-methyl- | SCHEMBL932337 | 6-METHYLCHROMONE | METHYLBROMODICHLOROACETATE | AKOS000275965 | D76209 | MFCD00218598 | 6-methylchromen-4-one | 6-Methyl-4-oxo-4H-1-benzopyran | 6-Methylchromone, AldrichCPR | 6-Methyl-4H-chromen-4-one # | 6-M

사양 및 순도

≥98%

보관 조건

Room temperature

배송

Normal

순수함

≥98%

이름과 식별자

Pubchem Sid

488190569

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488190569

정식 스마일

CC1=CC2=C(C=C1)OC=CC2=O

IUPAC Name

6-methylchromen-4-one

InChIKey

HTXQVFXXVXOLCF-UHFFFAOYSA-N

INCHI

1S/C10H8O2/c1-7-2-3-10-8(6-7)9(11)4-5-12-10/h2-6H,1H3

이성체 SMILES

CC1=CC2=C(C=C1)OC=CC2=O

대체 CAS

207511-19-1

분자량

160.17

Reaxy-Rn

118756

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=118756&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 분류 Benzopyrans
      • Subclass 1-benzopyrans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 분류: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Not available
• Direct Parent: Chromones
• Alternative Parents: Pyranones and derivatives Benzenoids Heteroaromatic compounds Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Chromone - Pyranone - Benzenoid - Pyran - Heteroaromatic compound - Oxacycle - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one 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

작용 메커니즘

화학 및 물리적 특성

• 용해성: Soluble in Methanol
• 녹는점(°C): 85-89°C
• 분자량: 160.170 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 160.052 Da
• Monoisotopic Mass: 160.052 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 220.000
• 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 ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 38445-23-7, the molecular formula is C10H8O2, and the molecular weight is 160.17 g/mol. InChIKey HTXQVFXXVXOLCF-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.