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Home > Encyclopedia > tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate

tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate

tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate structure

tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate 

structure
  • CAS No:

    185099-67-6

  • Formula:

    C12H19NO3

  • Chemical Name:

    tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate

  • Synonyms:

    N-(tert-Butoxycarbonyl)nortropinone; N-Boc-nortropinone; 8-Boc-3-oxo-8-azabicyclo[3.2.1]octane; N-Boc-4-Nortropinone; tert-Butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate; N-(tert-Butoxycarbonyl)-8-azabicyclo[3.2.1]octan-3-one; Boc-nortropinone;Expand

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate Basic Attributes

225.28400

225.13649347

DTXSID30383393

2933990090

Characteristics

46.61000

2.05530

off-white solid

1.139 g/cm3

58-59ºC

325.8ºC at 760 mmHg

150.8ºC

1.507

Store at 0-5ºC

0.000225mmHg at 25°C

Safety Information

3

R36/37/38

26-39

Xi

|Warning|H315 (97.87%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 94 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:225.28
XLogP3:1.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:225.13649347
Monoisotopic Mass:225.13649347
Topological Polar Surface Area:46.6
Heavy Atom Count:16
Complexity:303
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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