| Identification | Back Directory | [Name]
ETHYL 4-ISOCYANATOBENZOATE | [CAS]
30806-83-8 | [Synonyms]
ETHYL 4-ISOCYANATOBENZOATE Ethyl p-isocyanatobenzoate Ethyl para-isocyanatobenzoate 4-CARBETHOXY-PHENYLISOCYANATE 4-carboethoxyphenyl isocyanate Ethyl 4-isocyanatobenzoate 97% Ethyl 4-isocyanatobenzoate, 99+% 4-Ethoxycarbonyphenyl isocyanate 4-(ETHOXYCARBONYL)PHENYL ISOCYANATE Ethyl 4-isocyanatobenzoate, 99+% 5GR 4-Carboethoxyphenyl isocyanate~Ethyl 4-isocyanatobenzoate | [EINECS(EC#)]
250-344-2 | [Molecular Formula]
C10H9NO3 | [MDL Number]
MFCD00002027 | [MOL File]
30806-83-8.mol | [Molecular Weight]
191.18 |
| Chemical Properties | Back Directory | [Appearance]
clear colorless to yellow liquid after melting | [Melting point ]
27-29 °C(lit.)
| [Boiling point ]
118-119 °C0.8 mm Hg(lit.)
| [density ]
1.2722 (rough estimate) | [refractive index ]
1.5310 (estimate) | [Fp ]
>230 °F
| [storage temp. ]
0-6°C | [form ]
solid | [Water Solubility ]
Hydrolyses in water. | [Sensitive ]
Moisture Sensitive | [BRN ]
882021 | [InChI]
1S/C10H9NO3/c1-2-14-10(13)8-3-5-9(6-4-8)11-7-12/h3-6H,2H2,1H3 | [InChIKey]
CFEPCPHKICBCJV-UHFFFAOYSA-N | [SMILES]
CCOC(=O)c1ccc(cc1)N=C=O | [CAS DataBase Reference]
30806-83-8 |
| Hazard Information | Back Directory | [Chemical Properties]
clear colorless to yellow liquid after melting | [Uses]
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. | [Synthesis Reference(s)]
The Journal of Organic Chemistry, 28, p. 71, 1963 DOI: 10.1021/jo01036a014 |
| Safety Data | Back Directory | [Hazard Codes ]
Xn,Xi | [Risk Statements ]
20/21/22-36/37/38-42 | [Safety Statements ]
26-27-37/39 | [RIDADR ]
2206 | [WGK Germany ]
3
| [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29291000 | [Storage Class]
11 - Combustible Solids | [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 |
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J & K SCIENTIFIC LTD.
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Alfa Aesar
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Energy Chemical
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