597581-64-1 ((Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI))

结构式：

Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI)MOL文件

CAS号：

597581-64-1

英文名称：

Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI)

分子式：

C₁₃H₁₉N₃O₅S

分子量：

329.37206196785

Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI)(597581-64-1)名称与标识符

名称

英文别名：

Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI);

标识符

InChIKey：

ABTNBYWQNFJWJF-VHSXEESVSA-N

Inchi：

1S/C13H19N3O5S/c1-13(2,3)21-12(19)15-8-4-5-16(11(18)14-8)9-7-22-10(6-17)20-9/h4-5,9-10,17H,6-7H2,1-3H3,(H,14,15,18,19)/t9-,10+/m0/s1

SMILES：

C(OC(C)(C)C)(=O)NC1C=CN([C@H]2O[C@@H](CO)SC2)C(=O)N=1

Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI)(597581-64-1)物化性质

实验特性

酸度系数(pKa) : 6.66±0.20(Predicted)
密度 : 1.44±0.1 g/cm3(Predicted)

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597581-64-1 ((Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI))

Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI)(597581-64-1)名称与标识符

名称

标识符

Carbamic acid, [1,2-dihydro-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-, 1,1-dimethylethyl ester (9CI)(597581-64-1)物化性质

实验特性

目录