3,7a-Diazacyclohepta(jk)fluoren-7(1H)-one, 2,3,3a,4,5,6-hexahydro-5,5-dimethyl-, (+-)-, (Z)-2-butenedioate (1:1)

Base Information

• Chemical Name: 3,7a-Diazacyclohepta(jk)fluoren-7(1H)-one, 2,3,3a,4,5,6-hexahydro-5,5-dimethyl-, (+-)-, (Z)-2-butenedioate (1:1)
• CAS No.: 87255-59-2
• Molecular Formula: C21H24N2O5
• Molecular Weight: 384.4257
• Mol file: 87255-59-2.mol

Synonyms:3,7a-Diazacyclohepta(jk)fluoren-7(1H)-one, 2,3,3a,4,5,6-hexahydro-5,5-dimethyl-, (+-)-, (Z)-2-butenedioate (1:1);87255-59-2;LS-59863

Chemical Property of 3,7a-Diazacyclohepta(jk)fluoren-7(1H)-one, 2,3,3a,4,5,6-hexahydro-5,5-dimethyl-, (+-)-, (Z)-2-butenedioate (1:1)

Chemical Property:

• Vapor Pressure: 2.05E-07mmHg at 25°C
• Boiling Point: 424.5°C at 760 mmHg
• Flash Point: 210.6°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 384.16852187
• Heavy Atom Count: 28
• Complexity: 538

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC2C3=C(CCN2)C4=CC=CC=C4N3C(=O)C1)C.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CC1(CC2C3=C(CCN2)C4=CC=CC=C4N3C(=O)C1)C.C(=C/C(=O)O)\C(=O)O