8-Chloro-10-(N-methylpropargylamino)-10,11-dihydrodibenzo(b,f)thiepin maleate

Base Information

• Chemical Name: 8-Chloro-10-(N-methylpropargylamino)-10,11-dihydrodibenzo(b,f)thiepin maleate
• CAS No.: 69195-59-1
• Molecular Formula: C22H20ClNO4S
• Molecular Weight: 429.9165
• Mol file: 69195-59-1.mol

Synonyms:VUFB-10542;8-Chloro-10-(N-methylpropargylamino)-10,11-dihydrodibenzo(b,f)thiepin maleate;69195-59-1;Dibenzo(b,f)thiepin-10-amine, 10,11-dihydro-8-chloro-N-methyl-N-2-propynyl-, (Z)-2-butenedioate (1:1);C18H16ClNS.C4H4O4;C18-H16-Cl-N-S.C4-H4-O4;LS-61344

Chemical Property of 8-Chloro-10-(N-methylpropargylamino)-10,11-dihydrodibenzo(b,f)thiepin maleate

Chemical Property:

• Vapor Pressure: 2.54E-07mmHg at 25°C
• Boiling Point: 421.8°Cat760mmHg
• Flash Point: 208.9°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 429.0801570
• Heavy Atom Count: 29
• Complexity: 522

Purity/Quality:

VUFB-10542 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(CC#C)C1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CN(CC#C)C1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C(=C/C(=O)O)\C(=O)O