3-Bromo-5-ethoxy-4-methoxybenzonitrile

Base Information

• Chemical Name: 3-Bromo-5-ethoxy-4-methoxybenzonitrile
• CAS No.: 515831-52-4
• Molecular Formula: C10H10BrNO2
• Molecular Weight: 256.1
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID00404009
• Wikidata: Q82207950
• Mol file: 515831-52-4.mol

Synonyms:3-bromo-5-ethoxy-4-methoxybenzonitrile;515831-52-4;MFCD02256583;DTXSID00404009;STK437200;AKOS000305189;AS-63865;CS-0308205;FT-0766217;EN300-110907;3-Bromo-5-ethoxy-4-methoxybenzonitrile, AldrichCPR

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

Chemical Property:

• Vapor Pressure: 0.000769mmHg at 25°C
• Refractive Index: 1.56
• 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-5-ethoxy-4-methoxybenzonitrile Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C(=CC(=C1)C#N)Br)OC