Diethyl ((5-bromo-1H-indol-3-yl)methylene)malonate

Base Information

• Chemical Name: Diethyl ((5-bromo-1H-indol-3-yl)methylene)malonate
• CAS No.: 93941-03-8
• Molecular Formula: C16H16 Br N O4
• Molecular Weight: 366.20654
• European Community (EC) Number: 300-502-2
• NSC Number: 163288
• DSSTox Substance ID: DTXSID80239917
• Nikkaji Number: J310.479F
• Mol file: 93941-03-8.mol

Synonyms:93941-03-8;Diethyl ((5-bromo-1H-indol-3-yl)methylene)malonate;EINECS 300-502-2;Diethyl 2-((5-bromo-1H-indol-3-yl)methylene)malonate;C16H16BrNO4;DIETHYL [(5-BROMO-1H-INDOL-3-YL)METHYLENE]MALONATE;NSC163288;diethyl 2-[(5-bromo-1H-indol-3-yl)methylidene]propanedioate;C16-H16-Br-N-O4;DTXSID80239917;AKOS024428991;NSC 163288;NSC-163288;FT-0767980;Diethyl2-((5-bromo-1H-indol-3-yl)methylene)malonate;ETHYL 5-BROMO-ALPHA-(ETHOXYCARBONYL)-3-INDOLEACRYLATE;[(5-Bromo-1H-indol-3-yl)methylene]propanedioic acid diethyl ester

Chemical Property of Diethyl ((5-bromo-1H-indol-3-yl)methylene)malonate

Chemical Property:

• Vapor Pressure: 7.22E-09mmHg at 25°C
• Boiling Point: 466.2°C at 760 mmHg
• Flash Point: 235.7°C
• PSA: 68.39000
• Density: 1.474g/cm³
• LogP: 3.44000
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 365.02627
• Heavy Atom Count: 22
• Complexity: 431

Purity/Quality:

99% ^*data from raw suppliers

ETHYL 5-BROMO-ALPHA-(ETHOXYCARBONYL)-3-INDOLEACRYLATE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(=CC1=CNC2=C1C=C(C=C2)Br)C(=O)OCC