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Home > Encyclopedia > tert-Butyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1(2H)-carboxylate

tert-Butyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1(2H)-carboxylate

tert-Butyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1(2H)-carboxylate structure

tert-Butyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1(2H)-carboxylate 

structure
  • CAS No:

    138647-49-1

  • Formula:

    C11H16F3NO5S

  • Chemical Name:

    tert-Butyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1(2H)-carboxylate

  • Synonyms:

    tert-butyl 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1-carboxylate;

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

tert-Butyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1(2H)-carboxylate Basic Attributes

331.30900

331.07012827

DTXSID90451067

Characteristics

81.29000

3.39600

1.4g/cm3

361.2ºC at 760mmHg

172.3ºC

1.481

0mmHg at 25°C

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:331.31
XLogP3:2.3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:331.07012827
Monoisotopic Mass:331.07012827
Topological Polar Surface Area:81.3
Heavy Atom Count:21
Complexity:528
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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