3-Bromo-4-ethoxy-5-methoxybenzonitrile

Base Information

• Chemical Name: 3-Bromo-4-ethoxy-5-methoxybenzonitrile
• CAS No.: 495396-35-5
• Molecular Formula: C10H10BrNO2
• Molecular Weight: 256.1
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID90352803
• Wikidata: Q82130166
• Mol file: 495396-35-5.mol

Synonyms:3-bromo-4-ethoxy-5-methoxybenzonitrile;495396-35-5;MFCD02256499;DTXSID90352803;BBL013654;STK397364;AKOS000273720;AS-63863;FT-0679445;3-Bromo-4-ethoxy-5-methoxybenzonitrile, AldrichCPR

Chemical Property of 3-Bromo-4-ethoxy-5-methoxybenzonitrile

Chemical Property:

• Vapor Pressure: 0.000769mmHg at 25°C
• Boiling Point: 306.5°C at 760 mmHg
• Flash Point: 139.2°C
• PSA: 42.25000
• Density: 1.46g/cm³
• LogP: 2.72808
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 254.98949
• Heavy Atom Count: 14
• Complexity: 225

Purity/Quality:

98%Min ^*data from raw suppliers

3-Bromo-4-ethoxy-5-methoxybenzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C=C(C=C1Br)C#N)OC