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4-Isocyanatobenzaldehyde
[CAS# 111616-43-4]

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Identification
Name 4-Isocyanatobenzaldehyde
Synonyms 4-isocyanatobenzaldehyde
Molecular Structure CAS#: 111616-43-4, 4-Isocyanatobenzaldehyde
Molecular Formula C8H5NO2
Molecular Weight 147.13
CAS Registry Number 111616-43-4
SMILES O=C=N\c1ccc(cc1)C=O
InChI 1S/C8H5NO2/c10-5-7-1-3-8(4-2-7)9-6-11/h1-5H
InChIKey PUINVXGYZJXMMX-UHFFFAOYSA-N
Properties
Density 1.115g/cm3 (Cal.)
Boiling point 253.172°C at 760 mmHg (Cal.)
Flash point 100.451°C (Cal.)
Refractive index 1.543 (Cal.)
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