(2,5-Bis(1-aziridinyl)-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)biscarbamic acid, bis(1-methylethyl) ester

Base Information

• Chemical Name: (2,5-Bis(1-aziridinyl)-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)biscarbamic acid, bis(1-methylethyl) ester
• CAS No.: 127786-82-7
• Molecular Formula: C18H24 N4 O6
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID80155668
• Wikidata: Q83023628
• Mol file: 127786-82-7.mol

Synonyms:127786-82-7;(2,5-Bis(1-aziridinyl)-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)biscarbamic acid, bis(1-methylethyl) ester;propan-2-yl N-[2,5-bis(aziridin-1-yl)-3,6-dioxo-4-(propan-2-yloxycarbonylamino)cyclohexa-1,4-dien-1-yl]carbamate;DTXSID80155668

Chemical Property of (2,5-Bis(1-aziridinyl)-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)biscarbamic acid, bis(1-methylethyl) ester

Chemical Property:

• Vapor Pressure: 1.94E-09mmHg at 25°C
• Boiling Point: 481.7°C at 760 mmHg
• Flash Point: 245.1°C
• PSA: 123.80000
• Density: 1.38g/cm³
• LogP: 0.74640
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 392.16958450
• Heavy Atom Count: 28
• Complexity: 724

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)OC(C)C)N3CC3