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Home > Encyclopedia > 1-azabicyclo[2.2.2]oct-8-yl 2-hydroxy-5-methyl-2-propan-2-yl-hex-5-en- 3-ynoate

1-azabicyclo[2.2.2]oct-8-yl 2-hydroxy-5-methyl-2-propan-2-yl-hex-5-en- 3-ynoate

1-azabicyclo[2.2.2]oct-8-yl 2-hydroxy-5-methyl-2-propan-2-yl-hex-5-en- 3-ynoate structure

1-azabicyclo[2.2.2]oct-8-yl 2-hydroxy-5-methyl-2-propan-2-yl-hex-5-en- 3-ynoate 

structure
  • CAS No:

    101564-61-8

  • Formula:

    C17H25NO3

  • Chemical Name:

    1-azabicyclo[2.2.2]oct-8-yl 2-hydroxy-5-methyl-2-propan-2-yl-hex-5-en- 3-ynoate

  • Synonyms:

    NSC665866;5-Hexen-3-ynoic acid,2-hydroxy-5-methyl-2-(1-methylethyl)-, 1-azabicyclo[2.2.2]oct-3-yl ester;3-Quinuclidyl isopropyl(3-methylbut-1-yn-3-enyl)glycolate A;ACMC-20m4m5;3-HEXYN-5-ENOIC ACID, 2-HYDROXY-2-ISOPROPYL-5-METHYL-, 3-QUINUCLIDINYL ESTER;CHEMBL1997327;CTK3J9913;DTXSID00906351;NSC-665866;1-Azabicyclo[2.2.2]oct-3-yl 2-hydroxy-2-isopropyl-5-methyl-5-hexen-3-ynoate

1-azabicyclo[2.2.2]oct-8-yl 2-hydroxy-5-methyl-2-propan-2-yl-hex-5-en- 3-ynoate Basic Attributes

291.391

291.183

665866

Characteristics

49.8

3.1

1.12g/cm3

406ºC at 760mmHg

199.4ºC

1.541

2.77E-08mmHg at 25°C

Computed Properties

Molecular Weight:291.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:291.18344366
Monoisotopic Mass:291.18344366
Topological Polar Surface Area:49.8
Heavy Atom Count:21
Complexity:491
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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