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About This Item
Linear Formula:
C6H5OCH2CH2CO2H
CAS Number:
Molecular Weight:
166.17
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Assay
99%
form
powder
bp
235-245 °C (lit.)
mp
98-100 °C (lit.)
SMILES string
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 key
BUSOTUQRURCMCM-UHFFFAOYSA-N
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (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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