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1-(3-Isocyanatophenyl)-Ethanone
[CAS# 23138-64-9]

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Identification
Classification Chemical reagent >> Organic reagent >> Cyanate ester / isocyanate
Name 1-(3-Isocyanatophenyl)-Ethanone
Synonyms 439940_Aldrich; 3-Acetylphenyl Isocyanate; 3-Isocyanatoacetophenone
Molecular Structure CAS#: 23138-64-9, 1-(3-Isocyanatophenyl)-Ethanone
Molecular Formula C9H7NO2
Molecular Weight 161.16
CAS Registry Number 23138-64-9
SMILES O=C=NC1=CC(=CC=C1)C(C)=O
InChI 1S/C9H7NO2/c1-7(12)8-3-2-4-9(5-8)10-6-11/h2-5H,1H3
InChIKey JASTZOAHAWBRLM-UHFFFAOYSA-N
Properties
Density 1.174 (Expl.)
1.1±0.1g/cm3 (Cal.)
Boiling point 271.1±23.0°C at 760 mmHg (Cal.)
154-155°C (Expl.)
Flash point 110°C (Expl.)
108.8±28.0°C (Cal.)
Refractive index 1.5625 (Expl.)
Safety Data
Safety Code S23;S26;S36/37;S45  Details
Risk Code R20/22;R36/37/38;R42  Details
Hazard Symbol symbol  X  Details
Transport Information UN2206
Safety Description DANGER: POISON, irritates skin, eyes, lungs
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