Chroman-3-one - ≥95% , CAS No.19090-04-1

CAS: 19090-04-1 Cat. No.: C191802 Fórmula: C₉H₈O₂ Peso molecular: 148.16 Número CE: 860-454-8

GRADE & PURITY ≥95%

Synonyms

A813455 | FT-0652586 | MFCD09996937 | SCHEMBL11075399 | 4H-chromen-3-one | 2H-chromen-3(4H)-one | 2H-Chromen-3-ol, AldrichCPR | 3-CHROMANONE | 2H-1-Benzopyran-3(4H)-one | SHHLMGCHMMCOOS-UHFFFAOYSA-N | 3,4-dihydro-2H-1-benzopyran-3-one | AKOS015915214 | DS

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

A813455 | FT-0652586 | MFCD09996937 | SCHEMBL11075399 | 4H-chromen-3-one | 2H-chromen-3(4H)-one | 2H-Chromen-3-ol, AldrichCPR | 3-CHROMANONE | 2H-1-Benzopyran-3(4H)-one | SHHLMGCHMMCOOS-UHFFFAOYSA-N | 3,4-dihydro-2H-1-benzopyran-3-one | AKOS015915214 | DS

Especificações e pureza

≥95%

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥95%

Nomes e identificadores

• Sorrisos canónicos: C1C(=O)COC2=CC=CC=C21
• IUPAC Name: 4H-chromen-3-one
• InChIKey: SHHLMGCHMMCOOS-UHFFFAOYSA-N
• INCHI: 1S/C9H8O2/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-4H,5-6H2
• SMILES isoméricas: C1C(=O)COC2=CC=CC=C21
• Peso molecular: 148.16
• Reaxy-Rn: 125272
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=125272&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Not available
• Direct Parent: 1-benzopyrans
• Alternative Parents: Alkyl aryl ethers Benzenoids Cyclic ketones Oxacyclic compounds Organic oxides Hydrocarbon derivatives Aldehydes
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1-benzopyran - Alkyl aryl ether - Benzenoid - Cyclic ketone - Ketone - Oxacycle - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
• 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

Propriedades químicas e físicas

• Sensibilidade: Moisture sensitive
• Peso molecular: 148.160 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 148.052 Da
• Monoisotopic Mass: 148.052 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 165.000
• 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

Perguntas frequentes

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 ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 19090-04-1, the molecular formula is C9H8O2, and the molecular weight is 148.16 g/mol. InChIKey SHHLMGCHMMCOOS-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.