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质量水平
方案
95%
折射率
n20/D 1.568 (lit.)
沸点
232-233 °C (lit.)
mp
−30 °C (lit.)
密度
1.064 g/mL at 25 °C (lit.)
SMILES字符串
C1Cc2ccccc2CN1
InChI
1S/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4,10H,5-7H2
InChI key
UWYZHKAOTLEWKK-UHFFFAOYSA-N
基因信息
human ... PNMT(5409)
rat ... Adra2a(25083) , Htr1a(24473)
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警示用语:
Danger
危险分类
Acute Tox. 2 Dermal - Acute Tox. 3 Oral - Acute Tox. 4 Inhalation - Aquatic Chronic 3 - Eye Dam. 1 - Skin Corr. 1B - STOT SE 2
储存分类代码
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
WGK
WGK 3
闪点(°F)
210.2 °F - closed cup
闪点(°C)
99 °C - closed cup
个人防护装备
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Gary L Grunewald et al.
Journal of medicinal chemistry, 49(18), 5424-5433 (2006-09-01)
3-Fluoromethyl-7-(N-substituted aminosulfonyl)-1,2,3,4-tetrahydroisoquinolines (14, 16, and 18-22) are highly potent and selective inhibitors of phenylethanolamine N-methyltransferase (PNMT). Molecular modeling studies with 3-fluoromethyl-7-(N-alkyl aminosulfonyl)-1,2,3,4-tetrahydroisoquinolines, such as 16, suggested that the sulfonamide -NH- could form a hydrogen bond with the side chain of
Staffan Skogvall et al.
Pulmonary pharmacology & therapeutics, 21(1), 125-133 (2007-03-22)
Current drugs including beta-agonists have limited smooth muscle relaxant effects on human small airways. Yet this is a major site of obstruction in asthma and chronic obstructive pulmonary disease (COPD). This study explores human small airway relaxant effects of RESPIR
Ajay Kumar Srivastava et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 17(17), 4905-4913 (2011-03-16)
We herein report a robust and efficient synthetic route to highly functionalized enantiopure 1,2,3,4-tetrahydroisoquinolines (THIQs) from Garner aldehyde. We utilized the inherent chirality of Garner aldehyde through 1,2- and 1,3-/1,4-asymmetric inductions iteratively to obtain 1,2,3,4-tetrasubstitued THIQs using rigid and isolable
Lucie Cahlíková et al.
Natural product communications, 5(7), 1035-1038 (2010-08-26)
The roots and aerial parts of Eschscholzia californica Cham. (Papaveraceae) were extracted with ethanol. Repeated column chromatography, preparative TLC, and crystallization led to the isolation of fourteen isoquinoline alkaloids, the structures of which were determined on the basis of spectroscopic
Matthias Ludwig et al.
European journal of medicinal chemistry, 41(8), 1003-1010 (2006-05-06)
A series of 1-aryl-1,2,3,4-tetrahydroisoquinoline and 8-methyl-1-aryl-1,2,3,4-tetrahydroisoquinoline derivatives was evaluated for affinity to the PCP binding site of the NMDA receptor complex. The (S)-configured tetrahydroisoquinoline derivative (S)-4 e x HCl bearing a 2-methylphenyl substituent in position 1 of the heterocyclic ring
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