1-Butanone, 1-benzo(b)thien-3-yl-4-(hexahydro-1H-azepin-1-yl)-, 2-hydroxy-1,2,3-propanetricarboxylate

Base Information

• Chemical Name: 1-Butanone, 1-benzo(b)thien-3-yl-4-(hexahydro-1H-azepin-1-yl)-, 2-hydroxy-1,2,3-propanetricarboxylate
• CAS No.: 61508-22-3
• Molecular Formula: C24H31NO8S
• Molecular Weight: 493.5698
• DSSTox Substance ID: DTXSID90210499

Synonyms:1-Butanone, 1-benzo(b)thien-3-yl-4-(hexahydro-1H-azepin-1-yl)-, 2-hydroxy-1,2,3-propanetricarboxylate;61508-22-3;C18H23NOS.C6H8O7;DTXSID90210499;LS-46627;C18-H23-N-O-S.C6-H8-O7

Chemical Property of 1-Butanone, 1-benzo(b)thien-3-yl-4-(hexahydro-1H-azepin-1-yl)-, 2-hydroxy-1,2,3-propanetricarboxylate

Chemical Property:

• Vapor Pressure: 7.89E-09mmHg at 25°C
• Boiling Point: 465.1°Cat760mmHg
• Flash Point: 235.1°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 10
• Exact Mass: 493.17703812
• Heavy Atom Count: 34
• Complexity: 566

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCCN(CC1)CCCC(=O)C2=CSC3=CC=CC=C32.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

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