2-(2-Isocyanatoethyl)-1,4-dimethoxybenzene

Base Information

• Chemical Name: 2-(2-Isocyanatoethyl)-1,4-dimethoxybenzene
• CAS No.: 480439-35-8
• Molecular Formula: C11H13NO3
• Molecular Weight: 207.228
• Hs Code.: 2929109000
• DSSTox Substance ID: DTXSID30584146
• Nikkaji Number: J2.765.992F
• Mol file: 480439-35-8.mol

Synonyms:480439-35-8;2,5-Dimethoxyphenethyl isocyanate;2-(2-isocyanatoethyl)-1,4-dimethoxybenzene;2,5-Dimethoxyphenethyl isocyanate, 97%;SCHEMBL1846057;DTXSID30584146;AKOS015912762;2,5-Dimethoxyphenethyl isocyanate,97%;EN300-322425

Chemical Property of 2-(2-Isocyanatoethyl)-1,4-dimethoxybenzene

Chemical Property:

• Vapor Pressure: 0.000463mmHg at 25°C
• Refractive Index: n20/D 1.5300(lit.)
• Boiling Point: 301-302 °C(lit.)
• Flash Point: >230 °F
• PSA: 47.89000
• Density: 1.153 g/mL at 25 °C(lit.)
• LogP: 1.58210
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 207.08954328
• Heavy Atom Count: 15
• Complexity: 226

Purity/Quality:

97% ^*data from raw suppliers

2,5-DIMETHOXYPHENETHYL ISOCYANATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38-42
• Safety Statements: 23-26-36

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1)OC)CCN=C=O