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1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate

1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate structure

CAS No:
101711-07-3
Formula:
C20H23NO3
Chemical Name:
1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate
Synonyms:
NSC665760;101711-07-3;3-Quinuclidyl phenyl(3-methyl-but-1-yn-3-enyl)glycolate A;3-Quinuclidyl phenyl(3-methyl-but-1-yn-3-enyl)glycolate B;MANDELIC ACID, alpha-(3-METHYLBUT-1-YN-3-ENYL)-, 3-QUINUCLIDINYL ESTER;CHEMBL1988605;DTXSID90906562;1-Azabicyclo[2.2.2]oct-3-yl 2-hydroxy-5-methyl-2-phenyl-5-hexen-3-ynoate;1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate;NSC-665760;NCI60_022743;quinuclidin-3-yl 2-hydroxy-5-methyl-2-phenyl-hex-5-en-3-ynoate;alpha-Hydroxy-alpha-(3-methyl-1-butyn-3-enyl)benzeneacetic acid 3-quinuclidinyl ester

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1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate Basic Attributes

Molecular Weight：

325.4 g/mol

Exact Mass：

325.16779360 g/mol

NSC Number：

665760

Characteristics

PSA：

49.8 Å²

Computed Properties

Molecular Weight:325.4
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:325.16779360
Monoisotopic Mass:325.16779360
Topological Polar Surface Area:49.8
Heavy Atom Count:24
Complexity:558
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-azabicyclo[2.2.2]octan-3-yl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate

Basic Attributes
Characteristics
Computed Properties
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