简介名称和标识符别名信息物化性质安全信息国际标准相关数据海关数据相关文献专业数据库参考相关产品

枸橼酸喷托维林 | 77-23-6

中文名称：枸橼酸喷托维林

英文名称： pentoxyverine

CAS No.： 77-23-6

分子式： C₂₀H₃₁NO₃

分子量： 333.46504

如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击：枸橼酸喷托维林结构式

MSDS：枸橼酸喷托维林MSDS

PubChem CID： 2562

价格行情：枸橼酸喷托维林价格

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枸橼酸喷托维林的其他展现形式

相关化合物

环戊君

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简介

Pentoxyverine (Carbetapentane) 是 sigma-1 受体激动剂，在豚鼠脑膜上的 Ki 值为 75 nM。Pentoxyverine 是一种中枢性咳嗽抑制剂，具有抗毒蕈碱和抗惊厥作用。Pentoxyverine 可用于抑制支气管阻滞剂，减弱咳嗽反射，支气管平滑肌松弛和降低气道阻力。

名称和标识符

InChIKey	CFJMRBQWBDQYMK-UHFFFAOYSA-N
Inchi	1S/C20H31NO3/c1-3-21(4-2)14-15-23-16-17-24-19(22)20(12-8-9-13-20)18-10-6-5-7-11-18/h5-7,10-11H,3-4,8-9,12-17H2,1-2H3
SMILES	CCN(CC)CCOCCOC(=O)C1(CCCC1)C2=CC=CC=C2

别名信息

- 中文别名 -

枸橼酸喷托维林
1-苯基环戊烷-1-羧酸-β-(β-二乙胺基乙氧基)乙酯
咳必清盐基
喷托维林
枸盐酸喷托维林

维静宁
1-苯基环戊烷-1-羧酸 2-(2-二乙胺基乙氧基)乙酯
a-酮亮氨酸钙
二水合双(对-磺酰苯基)苯基膦化二钾盐
枸橼酸喷托维林咳必清
枸橼酸喷托维林-参考光谱
糠甾醇
咳必清
咳必清(枸橼酸喷托维林)
托可拉斯
妥克拉司

- 英文别名 -

pentoxyverine
Pentoxyverine Citrate
1-phenyl-1-cyclopentanecarboxylate
1-Phenylcyclopentane-1-Carboxylic acid diethylaminoethoxyethyl ester
1-phenyl-cyclopentanecarboxylicaci2-(2-(diethylamino)ethoxy)ethylester

1-phenylcyclopentanecarboxylicacid2-(2-diethylaminoethoxy)ethylester
2-(2-Diethylaminoethoxy)ethyl 1-phenylcyclopentanecarboxylate
2-(Diethylaminoethoxy)ethyl 1-phenyl-1-cyclopentanecarboxylate
2-(2-Diethylaminoethoxy)ethyl 1-phenylcyclopentanecarboxylate citrate
Atussil
Carbetapentane
carbita Pentane
Pentoxiverin
Pentoxiverine
Pentoxyverin
Sedotussin
Tuclase
ucb2543
Urex
2-(2-Diethylaminoethoxy)ethyl 1-phenylcyclopentane-1-carboxylate
UNII-32C726X12W
2-[2-(diethylamino)ethoxy]ethyl 1-phenylcyclopentanecarboxylate
PDSP2_001656
PENTOXYVERINE [WHO-DD]
Tox21_110909_1
CARBAPENTANE
2-(Diethylaminoethoxy)ethyl 1-phenylcyclopentyl-1-carboxylate
2-{[2-(diethylamino)ethyl]oxy}ethyl 1-phenylcyclopentanecarboxylate
Pentoxyverinum [INN-Latin]
1-Phenylcyclopentanecarboxylic acid,2-(2-(diethylamino)ethoxy)ethyl ester
PENTOXYVERINE (BASE)
Pentoxiverinum
2-[2-(Diemthylamino)ethoxy]ethyl 1-phenylcyclopentanecarboxylate
LS-57906
DB11186
Toclase (Salt/Mix)
Pentoxyverinum
SPBio_002494
KBio2_006982
pentoxyverin-
2,2-DIMETHYL-7-OCTENOICACID
Spectrum_001952
EN300-18551609
Pentoxyverine
KBioGR_001541
IDI1_000356
KBioSS_001846
Spectrum4_001021
S0869
PDSP1_001673
C20H31NO3
NCGC00024595-01
CAS-77-23-6
MS-25033
D08334
SBI-0050301.P003
BRD-K06181161-048-07-8
Spectrum_001366
CFJMRBQWBDQYMK-UHFFFAOYSA-N
W-104325
AB00053602
Sedotussin (TN)
1-Phenylcyclopentanecarboxylic acid 2-(2-diethylaminoethoxy)ethyl ester
KBio2_002498
2-[2-(diethylamino)ethoxy]ethyl 1-phenylcyclopentane-1-carboxylate
PENTOXYVERINE [MART.]
CS-0136428
Tuclase (Salt/Mix)
UCB 2543
Ethanol, 2-(2-(diethylamino)ethoxy)-, 1-phenylcyclopentanecarboxylate (ester)
KBio2_004414
KBio1_000356
Prestwick0_000387
1-phenylcyclopentanecarboxylic acid 2-[2-(diethylamino)ethoxy]ethyl ester
U.C.B. 2543
Cyclopentanecarboxylic acid, 1-phenyl-, 2-(2-(diethylamino)ethoxy)ethyl ester
PENTOXYVERINE [HSDB]
BDBM94507
D09VBC
NCGC00024595-15
DTXCID102734
PENTOXYVERINE [INN]
KBio2_001846
KBio2_005066
CHEMBL73234
DTXSID9022734
SPBio_001484
NINDS_000356
Tox21_110909
1-phenyl-1-cyclopentanecarboxylic acid 2-[2-(diethylamino)ethoxy]ethyl ester
HSDB 3299
KBioSS_002506
CCG-204408
Spectrum2_001412
citric acid
1-phenylcyclopentanecarboxylic acid 2-[2-(diethylamino)ethoxy]ethyl ester
32C726X12W
KBio3_001924
NCGC00024595-04
Cyclopentanecarboxylic acid, 1-phenyl-, 2-[2-(diethylamino)ethoxy]ethyl ester
NCGC00024595-02
Prestwick3_000387
2-hydroxypropane-1,2,3-tricarboxylic acid
1-phenyl-1-cyclopentanecarboxylic acid 2-[2-(diethylamino)ethoxy]ethyl ester
DivK1c_000356
SDCCGSBI-0050301.P004
CHEBI:94484
Ethanol, 2-[2-(diethylamino)ethoxy]-, 1-phenylcyclopentanecarboxylate (ester)
Pentoxyverine (INN)
BSPBio_000573
77-23-6
Sedotussin (Salt/Mix)
Pentoxyverine [INN:BAN]
1-Phenylcyclopentane-1-carboxylic acid diethylaminoethoxyethyl ester
2-(2-diethylaminoethoxy)ethyl 1-phenylcyclopentyl-1-carboxylate
carbetapentane
Prestwick2_000387
NCGC00024595-03
F87719
CARBETAPENTANE [VANDF]
AB00053602_09
2-(2-Diethylaminoethoxy)ethyl 1-phenylcyclopentane-1-carboxylate
2-hydroxypropane-1,2,3-tricarboxylic acid
KBio2_007634
Pentoxiverina
cid_90010
Prestwick1_000387
1-Phenyl-1-cyclopentanecarboxylate
Pentoxiverina [INN-Spanish]
NCGC00024595-06
CARBETAPENTANE [MI]
Cyclopentanecarboxylic acid, 1-phenyl-, 2-(2-(diethylamino)ethoxy)ethylester
Tocris-0454
SCHEMBL67879
NCGC00024595-05
2-(2-(diethylamino)ethoxy)ethyl 1-phenylcyclopentanecarboxylate
UNII-23K1F351T7
NCGC00024595-08
BPBio1_000631
Lopac0_000313
Q174786
1-Cyclopentanecarboxylate, 2-(diethylaminoethoxy)ethyl-1-phenyl-
BRN 2299701
BRD-K06181161-048-04-5
Spectrum3_000922
FT-0603066
AKOS015918339
HY-134004
EINECS 201-014-1
2-[2-(diethylamino)ethoxy]ethyl 1-phenylcyclopentane-1-carboxylate
2-oxidanylpropane-1,2,3-tricarboxylic acid
NS00006529

物化性质

实验特性

LogP	3.40000
PSA	38.77000
折射率	1.4990-1.5010
沸点	165-170 ºC (1.33Pa)
熔点	90-95
蒸气压	0.0±1.0 mmHg at 25°C
闪点	217
颜色与性状	油状物。
密度	1.048

计算特性

精确分子量	333.23000
氢键供体数量	0
氢键受体数量	4
可旋转化学键数量	11
同位素质量	333.23
重原子数量	24
复杂度	356
同位素原子数量	0
确定原子立构中心数量	0
不确定原子立构中心数量	0
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）	3.8
互变异构体数量	无
表面电荷	0
拓扑分子极性表面积	38.8A^2

安全信息

WGK Germany	3
安全说明	S26-S36
风险术语	R36/37/38
危险品标志	Xi
危害声明	H303+H313+H333
警示性声明	P264+P280+P305+P351+P338+P337+P313
储存条件	storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
信号词	warning

国际标准相关数据

EINECS	201-014-1

海关数据

海关编码	2921300090
海关数据	中国海关编码： 2921300090 概述： 2921300090 其他环（烷，烯，萜烯）单胺或多胺（包括其衍生物及它们的盐）. 增值税率:17.0% 退税率:9.0% 监管条件:无最惠国关税:6.5% 普通关税:30.0% 申报要素：品名, 成分含量, 用途 Summary： 2921300090 other cyclanic, cyclenic or cyclotherpenic mono- or polyamines, and their derivatives; salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

海关编码

2921300090

海关数据

中国海关编码：

2921300090

概述：

2921300090 其他环（烷，烯，萜烯）单胺或多胺（包括其衍生物及它们的盐）. 增值税率:17.0% 退税率:9.0% 监管条件:无最惠国关税:6.5% 普通关税:30.0%

申报要素：

品名, 成分含量, 用途

Summary：

2921300090 other cyclanic, cyclenic or cyclotherpenic mono- or polyamines, and their derivatives; salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

相关文献

1. Standardised thin-layer chromatographic systems for the identification of drugs and poisons. A review
A. H. Stead,R. Gill,T. Wright,J. P. Gibbs,A. C. Moffat Analyst 1982 107 1106
2. Lewis acid-promoted hetero Diels–Alder reaction of α,β-unsaturated thioketones
Shinichi Motoki,Takao Saito,Takayuki Karakasa,Teruyuki Matsushita,Eiji Furuno J. Chem. Soc. Perkin Trans. 1 1992 2943
3. Tris(2,2′-bipyridyl)ruthenium(ii) chemiluminescence enhanced by silver nanoparticles
Bree A. Gorman,Paul S. Francis,Dave E. Dunstan,Neil W. Barnett Chem. Commun. 2007 395
4. Chemistry of O-silylated ketene acetals: an efficient synthesis of carbapenem and 1β-methylcarbapenem intermediates
Yasuyuki Kita,Norio Shibata,Takashi Tohjo,Naoki Yoshida J. Chem. Soc. Perkin Trans. 1 1992 1795
5. Radical cyclization of alkynyl aryl ketones for the synthesis of 3-seleno-substituted thiochromones and chromones
Ricardo H. Bartz,Krigor B. Silva,Thiago J. Peglow,Angelita M. Barcellos,Raquel G. Jacob,Eder J. Lenard?o,Gelson Perin Org. Biomol. Chem. 2022 20 8952
6. Some aspects of the recent development of drug ion-selective electrodes
Yao Shouzhuo,Nie Lihua,Cai Li-Zhen,Pan Jing-Hao,Cui Song-Lin,J. F. van Staden,Guo Dingli,Wang Juhuang,Chen Jinbiao,Nie Feng,Guo Dingli,Ji Changlin,He Ping,Gao Huashou Anal. Proc. 1987 24 338
7. The simplest Diels–Alder reactions are not endo-selective
William J. Lording,Thomas Fallon,Michael S. Sherburn,Michael N. Paddon-Row Chem. Sci. 2020 11 11915
8. The simplest Diels–Alder reactions are not endo-selective
William J. Lording,Thomas Fallon,Michael S. Sherburn,Michael N. Paddon-Row Chem. Sci. 2020 11 11915
9. Highly stereoselective boron trifluoride-promoted 5-endo cyclisation of epoxy-allylic stannanes
Makoto Yoshitake,Makoto Yamamoto,Shigeo Kohmoto,Kazutoshi Yamada J. Chem. Soc. Perkin Trans. 1 1991 2157
10. Synthesis and characterization of zeolite (MFI) membranes on porous ceramic supports
Eduard R. Geus,Marcel J. den Exter,Herman van Bekkum J. Chem. Soc. Faraday Trans. 1992 88 3101

专业数据库参考

PubChemId	2562

枸橼酸喷托维林 | 77-23-6

中国海关编码：

概述：

申报要素：

Summary：

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