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4-ethynyl-1-azabicyclo[2.2.2]octane

4-ethynyl-1-azabicyclo[2.2.2]octane structure

CAS No:
52547-86-1
Formula:
C9H13N
Chemical Name:
4-ethynyl-1-azabicyclo[2.2.2]octane
Synonyms:
4-ethynyl-1-azabicyclo[2.2.2]octane;1-Azabicyclo(2.2.2)octane, 4-ethynyl-;52547-86-1;4-Ethynylquinuclidine;1-Azabicyclo[2.2.2]octane,4-ethynyl-;SCHEMBL21835615;DTXSID10200534;ZINC5112329

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4-ethynyl-1-azabicyclo[2.2.2]octane Basic Attributes

Molecular Weight：

135.21 g/mol

Exact Mass：

135.104799419 g/mol

DSSTox ID：

DTXSID10200534

Characteristics

PSA：

3.2 Å²

XLogP3：

1.0434

Computed Properties

Molecular Weight:135.21
XLogP3:1.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:135.104799419
Monoisotopic Mass:135.104799419
Topological Polar Surface Area:3.2
Heavy Atom Count:10
Complexity:164
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-ethynyl-1-azabicyclo[2.2.2]octane

Basic Attributes
Characteristics
Computed Properties

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