Chemical Properties of 3-Isocyanatoacetophenone (CAS 23138-64-9)

3-Isocyanatoacetophenone

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InChI
InChI=1S/C9H7NO2/c1-7(12)8-3-2-4-9(5-8)10-6-11/h2-5H,1H3
InChI Key
JASTZOAHAWBRLM-UHFFFAOYSA-N
Formula
C9H7NO2
SMILES
CC(=O)c1cccc(N=C=O)c1
Molecular Weight1
161.16
CAS
23138-64-9
Other Names
  • 3-Acetylphenyl isocyanate
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Physical Properties

Property Value Unit Source
Δfgas -122.02 kJ/mol Joback Calculated Property
Δvap 54.84 kJ/mol Joback Calculated Property
log10WS -6.61 Crippen Calculated Property
logPoct/wat 1.856 Crippen Calculated Property
McVol 122.730 ml/mol McGowan Calculated Property
Pc 3768.41 kPa Joback Calculated Property
Tboil 557.52 K Joback Calculated Property
Tc 785.09 K Joback Calculated Property

Similar Compounds

3-Acetylphenylisothiocyanate. 3-Aminoacetophenone. 4-Isocyanatoacetophenone. Ethanone, 1-(3-nitrophenyl)-. 2-Bromo-3'-nitroacetophenone. 4-Acetylphenylisothiocyanate. 3-Nitrobenzeneacetyl chloride. 3-Ethylphenyl isocyanate. Ethanone, 1-(2-aminophenyl)-. 4-Acetamidoacetophenone. Acetophenone, 4'-amino-. Acetophenone, 4'-nitro-. 4-Bromo-3'-nitroacetophenone. (CH3)2N-CH=N-(4-acetylphenyl). 1-(3-Aminophenyl)-1-butanone.

Find more compounds similar to 3-Isocyanatoacetophenone.

Sources

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