((S)-3-(Tert-butoxycarbonyl)-2,2-dimethyloxazolidin-4-YL)methyl 4-methylbenzenesulfonate

HCID 10786336

基本情報

標準SMILES
Cc1ccc(S(=O)(=O)OC[C@@H]2COC(C)(C)N2C(=O)OC(C)(C)C)cc1
InChIKey
KBDJCRUNHXFKLI-AWEZNQCLSA-N
分子式
C18H27NO6S
平均分子量
385.5 g/mol
単同位体質量
385.15590875

名称と識別子

優先名称
((S)-3-(Tert-butoxycarbonyl)-2,2-dimethyloxazolidin-4-YL)methyl 4-methylbenzenesulfonate
IUPAC
tert-butyl (4S)-2,2-dimethyl-4-[(4-methylphenyl)sulfonyloxymethyl]-1,3-oxazolidine-3-carboxylate

名称と別名

140645-28-93-BOC-(4S)-Tosyloxymethyl-2,2-dimethyloxazolidineMFCD11041414((S)-3-(TERT-BUTOXYCARBONYL)-2,2-DIMETHYLOXAZOLIDIN-4-YL)METHYL 4-METHYLBENZENESULFONATETert-butyl (4S)-2,2-dimethyl-4-[(4-methylphenyl)sulfonyloxymethyl]-1,3-oxazolidine-3-carboxylateKBDJCRUNHXFKLI-AWEZNQCLSA-NSCHEMBL2669188BS-27374SY463009TERT-BUTYL (4S)-2,2-DIMETHYL-4-{[(4-METHYLBENZENESULFONYL)OXY]METHYL}-1,3-OXAZOLIDINE-3-CARBOXYLATEEN300-7388346(S)-(3-Boc-2,2-dimethyloxazolidin-4-yl)methyl Tosylate
名称をさらに表示
t-butyl (S)-2,2-dimethyl-4-(p-tolylsulfonyloxymethyl)-3-oxazolidinecaboxylatet-butyl (S)-2,2-dimethyl-4-(p-tolylsulfonyloxymethyl)-3-oxazolidinecarboxylatetert-butyl (4S)-2,2-dimethyl-4-(p-tolylsulfonyloxymethyl)oxazolidine-3-carboxylate(S)-2,2-Dimethyl4-(toluene-4-sulfonyloxymethyl)-oxazolidine-3-carboxylic acid tert-butyl ester(S)-2,2-Dimethyl4-(toluene4-sulfonyloxymethyl)-oxazolidine-3-carboxylic acid tert-butyl ester

データベース識別子

PubChem CID
10786336
Nikkaji
J2.470.658C

物性

構造計算による物性

XLogP
2.9
極性表面積
90.5 Ų
水素結合供与体数
0
水素結合受容体数
6
回転可能結合数
6
重原子数
26

関連反応

11 件

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