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1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)

1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI) structure

CAS No:
158568-64-0
Formula:
C8H15NOS
Chemical Name:
1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)
Synonyms:
(S)-3-(mercaptomethyl)quinuclidin-3-ol;C8H15NOS;(3S)-3-(Sulfanylmethyl)-1-azabicyclo[2.2.2]octan-3-ol;PubChem19412;CTK8B9655;DTXSID10576206;7956AA;ANW-62850;ZINC38282360;AKOS006307049

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1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI) Basic Attributes

Molecular Weight：

173.28

Exact Mass：

173.08700

DSSTox ID：

DTXSID10576206

Characteristics

PSA：

62.27000

XLogP3：

0.31080

Density：

1.21±0.1 g/cm3(Predicted)

Boiling Point：

286.0±15.0 °C(Predicted)

Computed Properties

Molecular Weight:173.28
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:173.08743528
Monoisotopic Mass:173.08743528
Topological Polar Surface Area:24.5
Heavy Atom Count:11
Complexity:156
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)

Basic Attributes
Characteristics
Computed Properties
Learn More Other Chemicals

1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, (S)- (9CI)

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