495581

3-Phenoxyphenyl isocyanate

98%

• Linear Formula: C₆H₅OC₆H₄NCO
• CAS Number: 87873-72-1
• Molecular Weight: 211.22
• MDL number: MFCD01863578
• UNSPSC Code: 12352100
• PubChem Substance ID: 24872986

Properties

• assay: 98%
• refractive index: n20/D 1.5925 (lit.)
• bp: 294 °C (lit.)
• density: 1.17 g/mL at 25 °C (lit.)
• storage temp.: 2-8°C
• SMILES string: O=C=Nc1cccc(Oc2ccccc2)c1
• InChI: 1S/C13H9NO2/c15-10-14-11-5-4-8-13(9-11)16-12-6-2-1-3-7-12/h1-9H
• InChI key: HOJSXCMKZBXNEN-UHFFFAOYSA-N

Description

General description

3-Phenoxyphenyl isocyanate, also known as 1-isocyanato-3-phenoxybenzene, is an organic building block containing an isocyanate group.

Application

3-Phenoxyphenyl isocyanate may be used in the synthesis of 1-(8-chloro-[1,2,4]triazolo[4,3-a]pyridine-3-carbonyl)-4-(3-phenoxyphenyl)semicarbazide.

Safety Information

• pictograms: GHS08,GHS07
• signalword: Danger
• hcodes: H302 + H312 + H332,H315,H317,H319,H334,H335
• pcodes: P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 230.0 °F - closed cup
• flash_point_c: 110 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter