Ethyl benzoylformate
Ethyl benzoylformate Basic information
- Product Name:
- Ethyl benzoylformate
- Synonyms:
-
- RARECHEM AL BI 0384
- PHENYLETHYLGLYOXYLATE
- PHENYLGLYOXYLIC ACID ETHYL ESTER
- alpha-oxo-benzeneaceticaciethylester
- Benzenaceticacid,-oxoethylester
- Benzeneaceticacid,α-oxo-,ethylester
- Ethyl oxophenylacetate
- Ethyloxophenylacetate
- CAS:
- 1603-79-8
- MF:
- C10H10O3
- MW:
- 178.18
- EINECS:
- 216-504-0
- Product Categories:
-
- Pharmaceutical Intermediates
- Aromatic Esters
- Esters
- Phenyls & Phenyl-Het
- API intermediates
- Phenyls & Phenyl-Het
- Mol File:
- 1603-79-8.mol
Ethyl benzoylformate Chemical Properties
- Boiling point:
- 138-139 °C/18 mmHg (lit.)
- Density
- 1.122 g/mL at 25 °C (lit.)
- refractive index
- 1.515-1.517
- Flash point:
- 113 °C
- storage temp.
- Store below +30°C.
- form
- Liquid
- Specific Gravity
- 1.122
- color
- Clear colorless to greenish
- Water Solubility
- Soluble in water 1143 mg/L @ 25°C .
- Sensitive
- Moisture Sensitive
- InChI
- InChI=1S/C10H10O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7H,2H2,1H3
- InChIKey
- QKLCQKPAECHXCQ-UHFFFAOYSA-N
- SMILES
- C1(C=CC=CC=1)C(=O)C(=O)OCC
- LogP
- 1.974 (est)
- CAS DataBase Reference
- 1603-79-8(CAS DataBase Reference)
- NIST Chemistry Reference
- Benzeneacetic acid, «alpha»-oxo-, ethyl ester(1603-79-8)
- EPA Substance Registry System
- Benzeneacetic acid, .alpha.-oxo-, ethyl ester (1603-79-8)
MSDS
- Language:English Provider:Ethyl phenylglyoxylate
- Language:English Provider:ACROS
- Language:English Provider:ALFA
Ethyl benzoylformate Usage And Synthesis
Chemical Properties
clear colorless to greenish liquid
Uses
Ethyl Benzoylformate is a general chemical reagent used in the preparation of diaminoethanediyl bismethylpyridinium salts for designing recyclable organocatalysts.
Application
Ethyl benzoylformate has been used in preparation of 1,5-dihydro-5-deazaflavin derivatives possessing a chiral substituent at N(3) position.
Definition
ChEBI: Ethyl benzoylformate is the ethyl ester of phenylglyoxylic acid. Metabolite observed in cancer metabolism. It has a role as a human metabolite. It derives from a phenylglyoxylic acid.
Synthesis Reference(s)
Journal of the American Chemical Society, 82, p. 918, 1960
The Journal of Organic Chemistry, 50, p. 3573, 1985 DOI: 10.1021/jo00219a025
Tetrahedron Letters, 23, p. 3661, 1982 DOI: 10.1016/S0040-4039(00)88651-7
General Description
Enantioselective hydrogenation of ethyl benzoylformate on Pt/Al2O3 modified with dihydrocinchonidine has been studied.
Ethyl benzoylformate Preparation Products And Raw materials
Raw materials
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Ethyl benzoylformate(1603-79-8)Related Product Information
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- Ethanol
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- Ethylparaben
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- ETHYL ANTHRANILATE
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- Ethyl benzoylacetate
- Ethyl pyruvate
- Ethyl formate
- ISOXADIFEN-ETHYL
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- ETHYL 4-METHOXYBENZOYLFORMATE
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- ETHYL MESITYLGLYOXYLATE
- Ethyl phenylacetate