7-Methylchroman-4-one - ≥95% , CAS No.18385-69-8

CAS: 18385-69-8 Cat. No.: M700983 Fórmula: C₁₀H₁₀O₂ Peso molecular: 162.18 PubChem CID: 2777830

CALIDAD & PUREZA ≥95%

Synonyms

2,3-Dihydro-7-methyl-4H-1-benzopyran-4-one | 4H-1-Benzopyran-4-one,2,3-dihydro-7-methyl- | 7-Methyl-2,3-dihydro-4H-1-benzopyran-4-one | 7-Methyl-2,3-dihydrochroMen-4-one | 7-methyl-3,4-dihydro-2H-1-benzopyran-4-one

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Especificaciones

Sinónimos

2,3-Dihydro-7-methyl-4H-1-benzopyran-4-one | 4H-1-Benzopyran-4-one,2,3-dihydro-7-methyl- | 7-Methyl-2,3-dihydro-4H-1-benzopyran-4-one | 7-Methyl-2,3-dihydrochroMen-4-one | 7-methyl-3,4-dihydro-2H-1-benzopyran-4-one

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Desiccated

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥95%

Nombres e identificadores

Sonrisas canónicas

CC1=CC2=C(C=C1)C(=O)CCO2

IUPAC Name

7-methyl-2,3-dihydrochromen-4-one

InChIKey

OKVHJJOYXWCTSA-UHFFFAOYSA-N

INCHI

1S/C10H10O2/c1-7-2-3-8-9(11)4-5-12-10(8)6-7/h2-3,6H,4-5H2,1H3

Isómeros SMILES

CC1=CC2=C(C=C1)C(=O)CCO2

PubChem CID

2777830

Peso molecular

162.18

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Not available
• Direct Parent: Chromones
• Alternative Parents: Aryl alkyl ketones Alkyl aryl ethers Benzenoids Oxacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Chromone - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Benzenoid - Ketone - Oxacycle - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Peso molecular: 162.180 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 162.068 Da
• Monoisotopic Mass: 162.068 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 188.000
• 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