1-[3-[(3,5-dimethoxyphenyl)methyl]azetidin-1-yl]ethanone - ≥97% , CAS No.1801243-45-7

CAS: 1801243-45-7 Cat. No.: A630526 Peso molecular: 249.3 PubChem CID: 118230647

GRADE & PURITY ≥97%

Synonyms

SCHEMBL16903768 | F90014 | 1-(3-(3,5-DIMETHOXYBENZYL)AZETIDIN-1-YL)ETHANONE | 1801243-45-7

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

SCHEMBL16903768 | F90014 | 1-(3-(3, 5-DIMETHOXYBENZYL)AZETIDIN-1-YL)ETHANONE | 1801243-45-7

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: CC(=O)N1CC(C1)CC2=CC(=CC(=C2)OC)OC
• IUPAC Name: 1-[3-[(3,5-dimethoxyphenyl)methyl]azetidin-1-yl]ethanone
• InChIKey: SAKWYTNTGIFZGM-UHFFFAOYSA-N
• INCHI: 1S/C14H19NO3/c1-10(16)15-8-12(9-15)4-11-5-13(17-2)7-14(6-11)18-3/h5-7,12H,4,8-9H2,1-3H3
• Isómeros SMILES: CC(=O)N1CC(C1)CC2=CC(=CC(=C2)OC)OC
• PubChem CID: 118230647
• Peso molecular: 249.3

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Methoxybenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Dimethoxybenzenes
• Alternative Parents: Phenoxy compounds Anisoles Alkyl aryl ethers Tertiary carboxylic acid amides Acetamides Azetidines Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: M-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Phenol ether - Anisole - Alkyl aryl ether - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - Azetidine - Azacycle - Organoheterocyclic compound - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic heteromonocyclic compound
• Descripción: 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