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4-tert-butyl-1-hex-5-ynyl-2,6,7-trioxabicyclo[2.2.2]octane-3-carbonitrile

4-tert-butyl-1-hex-5-ynyl-2,6,7-trioxabicyclo[2.2.2]octane-3-carbonitrile structure

CAS No:
121317-56-4
Formula:
C16H23NO3
Chemical Name:
4-tert-butyl-1-hex-5-ynyl-2,6,7-trioxabicyclo[2.2.2]octane-3-carbonitrile
Synonyms:
121317-56-4;SCHEMBL9261318;DTXSID50923775;1-tert-Butyl-4-hex-5-ynyl-3,5,8-trioxabicyclo(2.2.2)octane-7-carbonitrile;1-tert-butyl-4-hex-5-ynyl-3,5,8-trioxabicyclo[2.2.2]octane-2-carbonitrile;3,5,8-Trioxabicyclo(2.2.2)octane-7-carbonitrile, 1-tert-butyl-4-hex-5-ynyl-;4-t-Butyl-1-(hex-5-ynyl)-2,6,7-trioxabicyclo[2.2.2]octane-3-carbonitrile;4-TERT-BUTYL-1-(HEX-5-YN-1-YL)-2,6,7-TRIOXABICYCLO[2.2.2]OCTANE-3-CARBONITRILE

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4-tert-butyl-1-hex-5-ynyl-2,6,7-trioxabicyclo[2.2.2]octane-3-carbonitrile Basic Attributes

Molecular Weight：

277.36 g/mol

Exact Mass：

277.16779360 g/mol

Characteristics

PSA：

51.5 Å²

Computed Properties

Molecular Weight:277.36
XLogP3:2.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:277.16779360
Monoisotopic Mass:277.16779360
Topological Polar Surface Area:51.5
Heavy Atom Count:20
Complexity:451
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-tert-butyl-1-hex-5-ynyl-2,6,7-trioxabicyclo[2.2.2]octane-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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