E12907
Ethyl benzoate
≥99%
Synonym(s):
Benzoic acid ethyl ester
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About This Item
Linear Formula:
C6H5COOC2H5
CAS Number:
Molecular Weight:
150.17
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
202-284-3
Beilstein/REAXYS Number:
1908172
MDL number:
Assay:
≥99%
Form:
liquid
vapor density
5.17 (vs air)
Quality Level
vapor pressure
1 mmHg ( 44 °C)
assay
≥99%
form
liquid
autoignition temp.
914 °F
refractive index
n20/D 1.504 (lit.)
bp
212 °C (lit.)
mp
−34 °C (lit.)
density
1.045 g/mL at 25 °C (lit.)
SMILES string
CCOC(=O)c1ccccc1
InChI
1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChI key
MTZQAGJQAFMTAQ-UHFFFAOYSA-N
Application
Ethyl benzoate is a general reagent to construct molecules with phenyl pendants such as phenyl bearing pyrazine-boron fluorescent complex. It can be used to prepare Horner′s phosphonate intermediate in the total synthesis of diospongins A and B. It is also a flavoring agent used in food and fragrance industry.
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Storage Class
10 - Combustible liquids
wgk
WGK 1
flash_point_f
190.4 °F - closed cup
flash_point_c
88 °C - closed cup
ppe
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
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A concise total synthesis of diospongins A and B.
Sabitha G, et al.
Helvetica Chimica Acta, 91(12), 2235-2239 (2008)
Densities and viscosities of binary mixtures of isoamyl acetate, ethyl caproate, ethyl benzoate, isoamyl butyrate, ethyl phenylacetate, and ethyl caprylate with ethanol at T=(288.15, 298.15, 308.15, and 318.15) K.
Sheu Y W and Tu C H
Journal of Chemical and Engineering Data, 51(2), 496-503 (2006)
Synthesis and fluorescence properties of novel pyrazine?boron complexes bearing a ?-iminoketone ligand.
Kubota Y, et al.
Organic Letters, 13(24), 6544-6547 (2011)