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Home > Encyclopedia > Ethyl 4-isocyanatobenzoate

Ethyl 4-isocyanatobenzoate

Ethyl 4-isocyanatobenzoate structure

Ethyl 4-isocyanatobenzoate 

structure
  • CAS No:

    30806-83-8

  • Formula:

    C10H9NO3

  • Chemical Name:

    Ethyl 4-isocyanatobenzoate

  • Synonyms:

    Benzoic acid,4-isocyanato-,ethyl ester;Benzoic acid,p-isocyanato-,ethyl ester;Ethyl p-isocyanatobenzoate;Ethyl 4-isocyanatobenzoate;4-(Ethoxycarbonyl)phenyl isocyanate;(p-Ethoxycarbonyl)phenyl isocyanate;4-Isocyanatobenzoic acid ethyl ester;1025436-22-9;1330062-09-3

Ethyl 4-isocyanatobenzoate Basic Attributes

191.18

191.18

250-344-2

DTXSID60184815

2929109000

Characteristics

55.73000

1.83060

1.2722

60 °C

144-148 °C @ Press: 17 Torr

>230 °F

1.5310 (estimate)

Hydrolyses in water.

0-6ºC

Safety Information

III

6.1

2206

3

20/21/22-36/37/38-42

26-27-37/39

Xn,Xi

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P285, P301+P312, P302+P352, P304+P312, P304+P340, P304+P341, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:191.18
XLogP3:3.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:191.058243149
Monoisotopic Mass:191.058243149
Topological Polar Surface Area:55.7
Heavy Atom Count:14
Complexity:238
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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