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Home > Encyclopedia > Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate

Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate

Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate structure

Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate 

structure
  • CAS No:

    303152-94-5

  • Formula:

    C19H21ClF3N3O5

  • Chemical Name:

    Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate

  • Synonyms:

    Spiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylic acid,1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydro-,ethyl ester;Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate

Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate Basic Attributes

463.84

463.84

Characteristics

82.5

3.1

Computed Properties

Molecular Weight:463.8
XLogP3:3.1
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:4
Exact Mass:463.1121830
Monoisotopic Mass:463.1121830
Topological Polar Surface Area:82.5
Heavy Atom Count:31
Complexity:702
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of Ethyl 1′-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d]isoxazole-6,4′-piperidine]-3-carboxylate

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