trans-3-(Benzo[1,3]dioxol-5-yloxymethyl)-4-(4'-fluoro-biphenyl-4-yl)-piperidine hydrochloride（CAS号：1217655-87-2）

帕罗西汀与化合物G(联苯)

基本信息

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CAS号

1217655-87-2

分子式

C25H25ClFNO3

分子量

441.93 g/mol

化学分类

基础化工原料有机化学品醚类

基础化工原料有机化学品杂环化合物

医药化工医药中间体杂环中间体

精细化工产品专用化学品紫外线稳定剂

农用化学品农药除草剂

实验室化学品科研化学品生化试剂

基本物理性质

物理状态

White to Yellow Solid

SMILES

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C1CNCC(C1C2=CC=C(C=C2)C3=CC=C(C=C3)F)COC4=CC5=C(C=C4)OCO5.Cl

InChI

InChI=1S/C25H24FNO3.ClH/c26-21-7-5-18(6-8-21)17-1-3-19(4-2-17)23-11-12-27-14-20(23)15-28-22-9-10-24-25(13-22)30-16-29-24;/h1-10,13,20,23,27H,11-12,14-16H2;1H/t20-,23-;/m1./s1

InChIKey

LXCDAUDXYHUOFQ-KFWGXXPESA-N

LogP

5.415300000000005

拓扑极性表面积

39.72 Å²

氢键供体/受体

1 / 4

复杂度

533

安全信息

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危险说明

H302 吞咽有害
急性毒性-经口

H315 造成皮肤刺激
皮肤腐蚀/刺激

H319 造成严重眼刺激
严重眼损伤/眼刺激

H335 可能造成呼吸道刺激
特定目标器官毒性-单次接触；呼吸道刺激

同义词与引用数据

英文

rac-trans-4-Defluoro-4-(4-fluorophenyl) Paroxetine Hydrochloride
(3R,4S)-3-[(1,3-Benzodioxol-5-yloxy)methyl]-4-(4'-fluoro-4-biphen ylyl)piperidine hydrochloride (1:1)
3-((Benzodioxol-5-yloxy)methyl)-4-(4'-fluorobiphenyl-4-yl)piperidine hydrochloride, (3SR,4RS)-
(+/-)trans-3-[(1,3-Benzodioxol-5-yloxy)methyl]-4-(4''-fluorophenyl-4'-phenyl)piperidine Hydrochloride
trans-3-(benzo[1,3]dioxol-5-yloxymethyl)-4-(4'-fluoro-biphenyl-4-yl)-piperidine hydrochloride
(-)-TRANS-3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4''-FLUOROPHENYL-4'-PHENYL)PIPERIDINE HYDROCHLORIDE
(3R,4S)-rel-3-[(1,3-Benzodioxol-5-yloxy)methyl]-4-(4'-fluoro[1,1'-biphenyl]-4-yl)-piperidine Hydrochloride
trans-3-(Benzo[1,3]dioxol-5-yloxymethyl)-4-(4'-fluorobiphenyl-4-yl)piperidine hydrochloride
(3R,4S)-Rel-3-((benzo(d)(1,3)dioxol-5-yloxy)methyl)-4-(4'-fluoro-(1,1'-biphenyl)-4-yl)piperidine hydrochloride
1217655-87-2
(+/-)-TRANS-3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-FLUOROPHENYL-4-PHENYL)PIPERIDINE HYDROCHLORIDE
trans-3-(Benzo(1,3)dioxol-5-yloxymethyl)-4-(4'-fluoro-biphenyl-4-yl)-piperidine HCl
Piperidine, 3-((1,3-benzodioxol-5-yloxy)methyl)-4-(4'-fluoro(1,1'-biphenyl)-4-yl)-, hydrochloride (1:1), (3R,4S)-rel-
TRANS-3-(BENZO[1,3]DIOXOL-5-YLOXYMETHYL)-4-(4'-FLUORO-BIPHENYL-4-YL)-PIPERIDINE HCL
UNII-G2N13OH0O2
3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4''-FLUOROPHENYL-4'-PHENYL)PIPERIDINE HYDROCHLORIDE, TRANS-(+/-)-
Paroxetine Related Compound G, rac-trans-4-Defluoro-4-(4-fluorophenyl) Paroxetine Hydrochloride; Paroxetine Related Compound G as Hydrochloride
G2N13OH0O2
3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4''-FLUOROPHENYL-4'-PHENYL)PIPERIDINE HYDROCHLORIDE, TRANS-(-)-
(3SR,4RS)-3-((Benzodioxol-5-yloxy)methyl)-4-(4'-fluorobiphenyl-4-yl)piperidine hydrochloride
trans-3-((Benzo[d][1,3]dioxol-5-yloxy)methyl)-4-(4'-fluoro-[1,1'-biphenyl]-4-yl)piperidine hydrochloride
(+/-)trans-3-((1,3-Benzodioxol-5-yloxy)methyl)-4-(4-fluorophenyl-4-phenyl)piperidine hydrochloride
54G82TSV4J
(3S,4R)-3-(1,3-benzodioxol-5-yloxymethyl)-4-[4-(4-fluorophenyl)phenyl]piperidine;hydrochloride