3-[2-(3,4-Dimethoxyphenyl)ethyl]-3,6-dimethyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-ium-8-one;iodide

Base Information

• Chemical Name: 3-[2-(3,4-Dimethoxyphenyl)ethyl]-3,6-dimethyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-ium-8-one;iodide
• CAS No.: 7460-53-9
• Molecular Formula: C23H26 N O5 . I
• Molecular Weight: 396.4557
• NSC Number: 59275
• ChEMBL ID: CHEMBL2001606
• Mol file: 7460-53-9.mol

Synonyms:NSC59275;7460-53-9;NSC-59275;CHEMBL2001606

Chemical Property of 3-[2-(3,4-Dimethoxyphenyl)ethyl]-3,6-dimethyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-ium-8-one;iodide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 523.08557
• Heavy Atom Count: 30
• Complexity: 637

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=O)OC2=C1C=C3C[N+](COC3=C2)(C)CCC4=CC(=C(C=C4)OC)OC.[I-]