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methyl (2S,3S)-3-{[tert-butyl(dimethyl)silyl]oxy}azetidine-2-carboxylate

HCID 178786017
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Basic information

CAS
1268522-45-7
Standard SMILES
COC(=O)[C@H]1NC[C@@H]1O[Si](C)(C)C(C)(C)C
InChIKey
JAQPWRGPRSIZNM-IUCAKERBSA-N
Molecular formula
C11H23NO3Si
Average molar mass
245.39 g/mol
Monoisotopic mass
245.14472013

Names & identifiers

Preferred name
methyl (2S,3S)-3-{[tert-butyl(dimethyl)silyl]oxy}azetidine-2-carboxylate
IUPAC
methyl (2S,3S)-3-[tert-butyl(dimethyl)silyl]oxyazetidine-2-carboxylate
English name
Methyl (2S,3S)-3-[(tert-butyldiMethylsilyl)oxy]azetidine-2-carbo
Molecular formula
C11H23NO3Si
Molecular weight
245.39

Names & synonyms

JAQPWRGPRSIZNM-IUCAKERBSA-NAKOS015900944methyl (2S,3S)-3-{[tert-butyl(dimethyl)silyl]oxy}azetidine-2-carboxylateMethyl (2S,3S)-3-[(tert-butyldiMethylsilyl)oxy]azetidine-2-Methyl (2S,3S)-3-[(tert-butyldiMethylsilyl)oxy]azetidine-2-carbomethyl (2S,3S)-3-[(tert-butyldimethylsilyl)oxy]azetidine-2-carboxylate2-Azetidinecarboxylic acid, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, methyl ester, (2R,3R)-rel-

Database identifiers

CAS
1268522-45-7
PubChem CID
53302300

Properties

Computed structural propertiesFilling in

Topological polar surface area
47.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
273

Physicochemical properties

Boiling point
258.827 · 258.827±40.00 °C(Press: 760.00 Torr)(predicted)
Density
0.996 · 0.996±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
7.482 · 7.482±0.60(predicted)

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