3601-90-9 (1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖,(2R,3S)-5-Chloro-2-(((4-chlorobenzoyl)oxy)methyl)tetrahydrofuran-3-yl 4-chlorobenzoate)

CAS号:
3601-90-9
中文名称:
1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖
英文名称:
(2R,3S)-5-Chloro-2-(((4-chlorobenzoyl)oxy)methyl)tetrahydrofuran-3-yl 4-chlorobenzoate
分子式:
C19H15Cl3O5
分子量:
429.6784

1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖(3601-90-9)名称与标识符

名称

中文别名:
1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖;1-氯-3,5-对氯苯甲酰基-2-脱氧-D-核糖;1-氯-3,5-二(O-对氯苯甲酰基)-2-脱氧-D-核糖;1-氯-3,5-二对氯苯甲酰基-2-脱;1-氯-3,5-二对氯苯甲酰氧基-D-呋喃核糖;1-氯-3,5-二(O-对氯苯甲酰基)-2-脱氧-D-核糖(吉西他滨中间体);1-氯-3,5-二(O-对氯苯甲酰基)-2-脱氧-D-核糖(曲氟尿苷中间体);1-氯-3‘5二氯苯甲酰氧基-2脱氧D核酸;1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖 (地西他宾);1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖,AR;1-氯-3,5-二对氯苯甲酰基-2-脱氧-D-核糖;1-氯-3.5-二对氯苯甲酰基-2-脱;
英文别名:
1-Chloro-3,5-di(4-chlorbenzoyl)-2-deoxy-D-ribose;1-Chloro-2-Deoxy-3,5-Di(O-P-Chlorobenzoyl)-D-Ribofuranose;2-Deoxy-3,5-bis-O-(4-chlorobenzoyl)-D-erythro-pent;3,5-O-Bis(4-chlorobenzoyl)-2-deoxy-D-ribofuranosyl;1-CHLORO-3,5-DIPARACHLOROBENZOYL-2-DEOXY-D-RIBOSE;1-Chloro-2-deoxy-3,5-bi (O-p-aldylbenzoyl)-D-ribofuranose;3,5-O-Bis(4-chlorobenzoyl)-2-deoxy-D-ribofuranosyl chloride;(2R,3S)-5-Chloro-2-(((4-chlorobenzoyl)oxy)methyl)-tetrahydrofuran-3-yl 4-chlorobenzoate;(2R,3S)-5-Chloro-2-(((4-chlorobenzoyl)oxy)methyl)tetrahydrofuran-3-yl 4-chlorobenzoate;1-Chloro-3,5-di-(p-chlorobenzoyl)-2-deoxy-D-ribose;1-chloro-3,5-di-O-p-chlorobenzoyl-1,2-di-deoxy-D-ribofuranose;1-chloro-3,5-di-p-chlorobenzoyl-D-ribofuranose;(2R,3S)-5-chloro-2-((4-chlorobenzoyloxy)methyl)tetrahydrofuran-3-yl 4-chlorobenzoate;PubChem21925;PubChem10764;C19H15Cl3O5;1-Chloro-3,5-bis-(4-chlorobenzoyl)-2-deoxy-D;CS-0017828;W-202496;SCHEMBL2182170;F10764;MFCD00672145;1-A-CHLORO-3,5-DI-O-(4-CHLOROBENZOYL)-2-DEOXY-D-RIBOFURANOSE;D-erythro-Pentofuranosylchloride, 2-deoxy-, 3,5-bis(4-chlorobenzoate);3601-90-9;3,5-Di-O-(p-chlorobenzoyl)-2-deoxy-a-D-ribofuranosyl Chloride;1-Chloro-3,5-di-(p-chlorobenzoyl)-2-deoxy-D-ribose, techn.;1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose;1-Chloro-3 pound not5-di(4-chlorbenzoyl)-2-deoxy-D-ribose;1-Chloro-3,5-di-(p-chlorobenzoyl)-2-deoxy-D-ribofuranose;2-Deoxy-3,5-bis(4-chlorobenzoate)-D-erythro-pentofuranosyl chloride;21740-23-8;[(2R,3S)-5-CHLORO-3-(4-CHLOROBENZOYLOXY)OXOLAN-2-YL]METHYL 4-CHLOROBENZOATE;AKOS015999555;2-Deoxy-a-D-erythro-pentofuranosyl Chloride 3,5-Bis(4-chlorobenzoate); 1-Chloro-2-deoxy-3,5-O-bis(p-chlorobenzoyl)-a-D-erythro-pentofuranose; 3,5-Bis(4-chlorobenzoyl)-2-deoxy-.alpha.-D-ribofuranosyl Chloride; NSC 140594; 3,5-Di-O-(p-chlorobenzoyl)-2-deoxy-a-D-ribofuranosyl Chloride;2-deoxy-3,5-di-O-(p-chlorobenzoyl)-ribofuranosyl chloride;AS-74143;[(2R,3S)-5-chloro-3-(4-chlorobenzoyl)oxyoxolan-2-yl]methyl 4-chlorobenzoate;

标识符

MDL:
MFCD00672145
InChIKey:
QEHCZULNFYDPPL-RTKIROINSA-N
Inchi:
1S/C19H15Cl3O5/c20-13-5-1-11(2-6-13)18(23)25-10-16-15(9-17(22)26-16)27-19(24)12-3-7-14(21)8-4-12/h1-8,15-17H,9-10H2/t15-,16+,17?/m0/s1
SMILES:
ClC1([H])C([H])([H])[C@@]([H])([C@@]([H])(C([H])([H])OC(C2C([H])=C([H])C(=C([H])C=2[H])Cl)=O)O1)OC(C1C([H])=C([H])C(=C([H])C=1[H])Cl)=O

1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖(3601-90-9)物化性质

实验特性

  • LogP : 2.66740
  • PSA : 111.90000
  • 折射率 : 1.61
  • 沸点 : 682.3°Cat760mmHg
  • 闪点 : 366.4°C
  • 密度 : 1.46

计算特性

  • 精确分子量 : 443.99300
  • 氢键供体数量 : 0
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 7
  • 同位素质量 : 427.998507g/mol
  • 重原子数量 : 27
  • 复杂度 : 516
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 2
  • 不确定原子立构中心数量 : 1
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 5.4
  • 拓扑分子极性表面积 : 61.8

1-氯-3,5-二对氯苯甲酰氧基-2-脱氧-D-核糖(3601-90-9)生产方法和用途

用途:
地西他宾中间体。

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