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4-Acetylphenyl isocyanate

CAS#[49647-20-3]
G-codeGEO-00039
Molecular formulaC9H7NO2
Molecular weight161.16
Synonyms 1-(4-isocyanatophenyl)ethanone ; 4'-Isocyanatoacetophenone
Structure of 4-Acetylphenyl isocyanate

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Specification

Appearanceyellowish crystalline powder
Purity97,9% (GC)
Melting point33-37°C
Identification1H NMR conforms to structure

Structural identification

CAS#[49647-20-3]
G-codeGEO-00039
SMILESO=C=NC1=CC=C(C(C)=O)C=C1
InChIInChI=1S/C9H7NO2/c1-7(12)8-2-4-9(5-3-8)10-6-11/h2-5H,1H3
InChI KeyInChIKey=MOZSVHZOUDIZMF-UHFFFAOYSA-N
Download structure as .mol

Regulatory Information

Not regulated as a dangerous good.

Transport InformationTOXIC SOLID, ORGANIC, N.O.S. UN2811 6.1/ PG III
GHS pictogram
GHS07_harmful
Signal WordWarning
Hazard Statements
H302 - H312 - H315 - H319 - H332 - H335

H302 – Harmful if swallowed
H312 – Harmful in contact with skin
H315 – Causes skin irritation
H319 – Causes serious eye irritation
H332 – Harmful if inhaled
H335 – May cause respiratory irritation

Precautionary Statements
P261 - P280 - P305+351+338

P261 – Avoid breathing dust/fume/gas/mist/vapours/spray:
P280 – Wear protective gloves/protective clothing/eye protection/face protection:
P305+351+338 – IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do – continue rinsing

Product categorization

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