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Merck
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重要文件

P16001

Sigma-Aldrich

3-苯氧基丙酸

99%

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About This Item

線性公式:
C6H5OCH2CH2CO2H
CAS號碼:
分子量::
166.17
EC號碼:
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22

品質等級

化驗

99%

形狀

powder

bp

235-245 °C (lit.)

mp

98-100 °C (lit.)

SMILES 字串

OC(=O)CCOc1ccccc1

InChI

1S/C9H10O3/c10-9(11)6-7-12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)

InChI 密鑰

BUSOTUQRURCMCM-UHFFFAOYSA-N

儲存類別代碼

11 - Combustible Solids

水污染物質分類(WGK)

WGK 3

閃點(°F)

Not applicable

閃點(°C)

Not applicable

個人防護裝備

Eyeshields, Gloves, type N95 (US)


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分析證明 (COA)

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Wayne D Vaccaro et al.
Bioorganic & medicinal chemistry letters, 16(2), 395-399 (2005-10-26)
We report the discovery of novel histamine H(3) receptor antagonists based on 4-[(1H-imidazol-4-yl)methyl]piperidine. The most potent compounds in the series (e.g., 7) result from the attachment of a substituted aniline amide to the main pharmacophore piperidine via a two-methylene linker.
Luc M LeBlanc et al.
Rapid communications in mass spectrometry : RCM, 30(19), 2133-2144 (2016-08-02)
When subjected to collisional activation, gas-phase carboxylate ions typically undergo decarboxylation. However, alternative fragmentation processes dominate when the carboxylate group is located within certain structural motifs. In this work, the fragmentation processes of β-substituted carboxylate ions are characterized to improve

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