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[1-acetyl-3,6-bis(tert-butylsulfanyl)-3,6-dihydro-2H-pyridin-2-yl] acetate

[1-acetyl-3,6-bis(tert-butylsulfanyl)-3,6-dihydro-2H-pyridin-2-yl] acetate structure

CAS No:
18794-20-2
Formula:
C17H29NO3S2
Chemical Name:
[1-acetyl-3,6-bis(tert-butylsulfanyl)-3,6-dihydro-2H-pyridin-2-yl] acetate
Synonyms:
NSC209889;NSC-209889;2-Pyridinol, 1-acetyl-3,6-bis(tert-butylthio)-1,2,3,6-tetrahydro-, acetate (ester);18794-20-2;1-Acetyl-2-acetoxy-3,6-di-t-butylmercapto-1,2,3,6-tetrahydropyridine;2-Acetoxy-1-acetyl-3,6-di(tert-butylthio)-1,2,3,6-tetrahydropyridine;1-Acetyl-3,6-bis(tert-butylsulfanyl)-1,2,3,6-tetrahydro-2-pyridinyl acetate #;2-ACETOXY-1-ACETYL-3,6-DI-TERT-BUTYLMERCAPTO-1,2,3,6-TETRAHYDRO-PYRIDINE

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[1-acetyl-3,6-bis(tert-butylsulfanyl)-3,6-dihydro-2H-pyridin-2-yl] acetate Basic Attributes

Molecular Weight：

359.6 g/mol

Exact Mass：

359.15888613 g/mol

NSC Number：

209889

Characteristics

PSA：

97.2 Å²

XLogP3：

3.9899

Melting Point：

116 - 117 °C (petroleum ether)

Computed Properties

Molecular Weight:359.6
XLogP3:3.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:359.15888613
Monoisotopic Mass:359.15888613
Topological Polar Surface Area:97.2
Heavy Atom Count:23
Complexity:477
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [1-acetyl-3,6-bis(tert-butylsulfanyl)-3,6-dihydro-2H-pyridin-2-yl] acetate

Basic Attributes
Characteristics
Computed Properties
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