2,3-Dimethoxyphenethyl isocyanate

Base Information

• Chemical Name: 2,3-Dimethoxyphenethyl isocyanate
• CAS No.: 480439-02-9
• Molecular Formula: C11H13NO3
• Molecular Weight: 207.22600
• Hs Code.: 2929109000
• European Community (EC) Number: 690-574-4
• DSSTox Substance ID: DTXSID50404731
• Mol file: 480439-02-9.mol

Synonyms:2,3-Dimethoxyphenethyl isocyanate;480439-02-9;1-(2-isocyanatoethyl)-2,3-dimethoxybenzene;SCHEMBL1846285;DTXSID50404731;AKOS015912477;2,3-Dimethoxyphenethyl isocyanate,97%;2,3-Dimethoxyphenethyl isocyanate, 97%;FT-0726834;EN300-1849476

Chemical Property of 2,3-Dimethoxyphenethyl isocyanate

Chemical Property:

• Vapor Pressure: 0.00159mmHg at 25°C
• Refractive Index: n20/D 1.5250(lit.)
• Boiling Point: 275-276oC(lit.)
• Flash Point: 185 °F
• PSA: 47.89000
• Density: 1.131 g/mL at 25oC(lit.)
• LogP: 1.58210
• Storage Temp.: 2-8°C
• XLogP3: 2.9
• 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:

≥98% ^*data from raw suppliers

2,3-Dimethoxyphenethyl isocyanate 97% ^*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:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC=CC(=C1OC)CCN=C=O

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