2H-1-Benzopyran-3-amine, 3,4-dihydro-N-(3-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)propyl)-5-methoxy-, (E)-2-butenedioate (1:1)

Base Information

• Chemical Name: 2H-1-Benzopyran-3-amine, 3,4-dihydro-N-(3-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)propyl)-5-methoxy-, (E)-2-butenedioate (1:1)
• CAS No.: 153804-56-9
• Molecular Formula: C26H31NO7S
• Molecular Weight: 501.5918
• Mol file: 153804-56-9.mol

Synonyms:153804-56-9;2H-1-Benzopyran-3-amine, 3,4-dihydro-N-(3-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)propyl)-5-methoxy-, (E)-2-butenedioate (1:1);C22H27NO3S.C4H4O4;LS-38992;C22-H27-N-O3-S.C4-H4-O4

Chemical Property of 2H-1-Benzopyran-3-amine, 3,4-dihydro-N-(3-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)propyl)-5-methoxy-, (E)-2-butenedioate (1:1)

Chemical Property:

• Vapor Pressure: 1.95E-13mmHg at 25°C
• Boiling Point: 579.8°C at 760 mmHg
• Flash Point: 304.4°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 9
• Exact Mass: 501.18212350
• Heavy Atom Count: 35
• Complexity: 570

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC2=C1CC(CO2)NCCCOC3=CC=CC4=C3SCCC4.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: COC1=CC=CC2=C1CC(CO2)NCCCOC3=CC=CC4=C3SCCC4.C(=C/C(=O)O)\C(=O)O