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Ethyl 4-isocyanatobenzoate

ALDRICH/159344 - 97%

CAS Number: 30806-83-8
Empirical Formula (Hill Notation): C10H9NO3
Molecular Weight: 191.18
EC Number: 250-344-2
MDL Number: MFCD00002027
Linear Formula: OCNC6H4CO2C2H5
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-159344-5G 5 g
 $143.00
1/EA		 Add To Favorites
45-159344-25G 25 g
 $686.00
1/EA		 Add To Favorites
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 159344-5G

 

assay 97%
bp 118-119 °C/0.8 mmHg (lit.)
form solid
functional group ester
  isocyanate
InChI 1S/C10H9NO3/c1-2-14-10(13)8-3-5-9(6-4-8)11-7-12/h3-6H,2H2,1H3
InChI key CFEPCPHKICBCJV-UHFFFAOYSA-N
mp 27-29 °C (lit.)
Quality Level 100 
SMILES string CCOC(=O)c1ccc(cc1)N=C=O
storage temp. 2-8°C
Application: Ethyl 4-isocyanatobenzoate was used in the preparation of cellulose carbamate and ester derivatives. It was also used in the preparation of ethyl 4-(3-(4-oxo-6-tridecyl-1,4-dihydropyrimidin-2-yl)ureido)benzoate and ethyl 4-(2-oxocyclohexanecarboxamido)benzoate.
Packaging: 5, 25 g in glass bottle
Purity 97%
bp 118-119 °C/0.8 mmHg (lit.)
mp 27-29 °C (lit.)
Storage Temp. 2-8°C
UNSPSC 12352100

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