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Home > Encyclopedia > 4-Benzoxazolamine

4-Benzoxazolamine

4-Benzoxazolamine structure

4-Benzoxazolamine 

structure
  • CAS No:

    163808-09-1

  • Formula:

    C7H6N2O

  • Chemical Name:

    4-Benzoxazolamine

  • Synonyms:

    4-Benzoxazolamine;4-Aminobenzoxazole;1,3-Benzoxazol-4-amine;(Benzoxazol-4-yl)amine

4-Benzoxazolamine Basic Attributes

134.13534

134.14

DTXSID70363255

2934999090

Characteristics

52

1.1

1.317 g/cm3

77-79°

282.296ºC at 760 mmHg

124.528ºC

Safety Information

IRRITANT

P264, P270, P301+P310, P321, P330, P405, P501

H301

|Danger|H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Benzoxazolamine Use and Manufacturing

b) The compound obtained in Example 40-1 (600 mg, 3.66 mmol) Palladium on carbon (300 mg) was added at 0 under an argon atmosphere in ethanol (10 ml) solution of. After hydrogen substitution, and stirred at room temperature overnight. After completion of the reaction, it was filtered through Celite, and the filtrate was concentrated under reduced pressure. The residue was purified by silica gel column chromatography (hexane / ethyl acetate) to give the title compound (404 mg, 82percent).

Computed Properties

Molecular Weight:134.14
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:134.048012819
Monoisotopic Mass:134.048012819
Topological Polar Surface Area:52
Heavy Atom Count:10
Complexity:129
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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