1-Isocyanato-2-(phenoxymethyl)benzene

Base Information

• Chemical Name: 1-Isocyanato-2-(phenoxymethyl)benzene
• CAS No.: 910037-00-2
• Molecular Formula: C₁₄H₁₁NO₂
• Molecular Weight: 225.247
• DSSTox Substance ID: DTXSID50594646
• Mol file: 910037-00-2.mol

Synonyms:1-isocyanato-2-(phenoxymethyl)benzene;910037-00-2;SCHEMBL14660705;DTXSID50594646;MS-22068;DB-078863

Chemical Property of 1-Isocyanato-2-(phenoxymethyl)benzene

Chemical Property:

• Vapor Pressure: 4.78E-05mmHg at 25°C
• Refractive Index: 1.555
• Boiling Point: 349.2°Cat760mmHg
• Flash Point: 157.6°C
• PSA: 38.66000
• Density: 1.07g/cm³
• LogP: 3.23290
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 225.078978594
• Heavy Atom Count: 17
• Complexity: 267

Purity/Quality:

98%min ^*data from raw suppliers

1-isocyanato-2-(phenoxymethyl)benzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCC2=CC=CC=C2N=C=O

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