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About This Item
Linear Formula:
FC6H4CO2CH3
CAS Number:
Molecular Weight:
154.14
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
98%
refractive index
n20/D 1.494 (lit.)
bp
90-92 °C/20 mmHg (lit.)
density
1.192 g/mL at 25 °C (lit.)
functional group
ester
fluoro
SMILES string
COC(=O)c1ccc(F)cc1
InChI
1S/C8H7FO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChI key
MSEBQGULDWDIRW-UHFFFAOYSA-N
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Application
Methyl 4-fluorobenzoate can be used in the synthesis of trisubstituted imidazole derivatives containing a 4-fluorophenyl group, a pyrimidine ring, and a CN- or CONH2-substituted benzyl moiety.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
10 - Combustible liquids
WGK
WGK 2
Flash Point(F)
172.4 °F - closed cup
Flash Point(C)
78 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Dae-Kee Kim et al.
Bioorganic & medicinal chemistry letters, 18(14), 4006-4010 (2008-06-24)
A series of trisubstituted imidazole derivatives containing a 4-fluorophenyl group, a pyrimidine ring, and a CN- or CONH(2)-substituted benzyl moiety have been synthesized and evaluated for p38alpha MAP kinase inhibitory activity. Among them, compounds 22c, 27b, and 28b inhibited p38alpha
Rafał Frański et al.
Journal of mass spectrometry : JMS, 53(5), 379-384 (2018-02-15)
Gas phase decompositions of protonated methyl benzoate and its conjugates have been studied by using electrospray ionization-collision induced dissociation-tandem mass spectrometry. Loss of CO2 molecule, thus transfer of methyl group, has been observed. In order to better understand this process
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