204254-96-6
中文名稱
5-(戊烷-3-基氧基)-7-氧代-雙環(huán)[4.1.0]庚-3-烯-3-羧酸乙酯
英文名稱
(1S,5R,6S)-Ethyl 5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate
CAS
204254-96-6
分子式
C14H22O4
MDL 編號
MFCD08063944
分子量
254.32
MOL 文件
204254-96-6.mol
更新日期
2026/05/28 12:17:59
204254-96-6 結(jié)構(gòu)式
基本信息
中文別名
5-(戊烷-3-基氧基)-7-氧代-雙環(huán)[4.1.0]庚-3-烯-3-羧酸乙酯 英文別名
[1s-(1a,5b,6a)]-5-(1-ethylpropoxy)-7-oxabicyclo[4.1.0]hept-3-ene-3-carboxylic acid ethyl ester(1S,5R,6S)-ETHYL 5-(PENTAN-3-YL-OXY)-7-OXA-BICYCLO[4.1.0]HEPT-3-ENE-3-CARBOXYLATE
ETHYL(3R,4S,5S)-4,5-EPOXY-3-(1-ETHYL-PROPOXY)-CYCLOHEX-1-ENE-1-CARBOXYLATE
ETHYL(3R,4S,5S)-4,5-EPOXY-3-(1-ETHYL-PROPOXY)-CYCLOHEX-1-ENE-1-CARBOXYLATE(INTERMEDIATE OF OSELTAMIVIR PHOSPHATE )
ethyl(3R, 4R, 5S)-4,5-epoxy-3-(1-ethylpropoxy)-1-cyclohexene-1-carboxylic acid
7-Oxabicyclo[4.1.0]hept-3-ene-3-carboxylic acid, 5-(1-ethylpropoxy)-, ethyl ester, (1S,5R,6S)-
-Oxabicyclo[4.1.0]hept-3-ene-3-carboxylicacid,5-(1-ethylpropoxy)-,ethylester,(1S,5R,6S)-
所屬類別
醫(yī)藥中間體：原料藥中間體物理化學性質(zhì)
熔點56-57°C
沸點336.5±42.0 °C(Predicted)
密度1.08±0.1 g/cm3(Predicted)
儲存條件Sealed in dry,Store in freezer, under -20°C
溶解度可溶于氯仿（少許）、甲醇（少許）
形態(tài)固體
顏色白色至灰白色
旋光度 (Optical Rotation)Consistent with structure
InChIInChI=1S/C14H22O4/c1-4-10(5-2)17-11-7-9(14(15)16-6-3)8-12-13(11)18-12/h7,10-13H,4-6,8H2,1-3H3/t11-,12+,13-/m1/s1
InChIKeyXZXCGRFGEVXWIT-FRRDWIJNSA-N
SMILES[C@]12([H])[C@]([H])(O1)[C@H](OC(CC)CC)C=C(C(OCC)=O)C2
CAS 數(shù)據(jù)庫204254-96-6(CAS DataBase Reference)
