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经验公式(希尔记法):
C15H19NO3 · HCl
化学文摘社编号:
分子量:
297.78
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
258-162-5
Beilstein/REAXYS Number:
3749159
MDL number:
产品名称
N-苄基-3-氧代哌啶-4-羧酸乙酯 盐酸盐, technical grade
InChI key
UQOMEAWPKSISII-UHFFFAOYSA-N
InChI
1S/C15H19NO3.ClH/c1-2-19-15(18)13-8-9-16(11-14(13)17)10-12-6-4-3-5-7-12;/h3-7,13H,2,8-11H2,1H3;1H
SMILES string
Cl[H].CCOC(=O)C1CCN(CC1=O)Cc2ccccc2
grade
technical grade
mp
162 °C (dec.) (lit.)
solubility
NH4OH: soluble 25 mg/mL, clear, yellow (Methanol)
functional group
ester
ketone
phenyl
Quality Level
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Application
用于合成受体激动剂和拮抗剂的有效结构单元。
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
法规信息
新产品
此项目有
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Organic Process Research & Development, 9, 80-80 (2005)
Jennifer M Frost et al.
Journal of medicinal chemistry, 49(26), 7843-7853 (2006-12-22)
A series of potent neuronal nicotinic acetylcholine receptor (nAChR) ligands based on a 3,8-diazabicyclo[4.2.0]octane core have been synthesized and evaluated for affinity and agonist efficacy at the human high affinity nicotine recognition site (halpha4beta2) and in a rat model of
P C Unangst et al.
Journal of medicinal chemistry, 40(17), 2688-2693 (1997-08-15)
The discovery of a series of chromeno[3,4-c]pyridin-5-ones with selective affinity for the dopamine D4 receptor is described. Target compounds were tested for binding to cloned human dopamine D2, D3, and D4 receptor subtypes expressed in Chinese hamster ovary (CHO) K-1
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