ETHYL 4-NITROBENZOYLACETATE

CAS No.
838-57-3
CCD No.
CCD00007060
Formula
C11 H11 N O5
MolWeight
237.21

Basic Information

Product Name: ETHYL 4-NITROBENZOYLACETATE
CAS: 838-57-3
English Synonyms: (P-NITROBENZOYL)ACETIC ACID ETHYL ESTER ; ETHYL 3-OXO-3-(P-NITROPHENYL)PROPIONATE ; ETHYL 3-(4-NITROPHENYL)-3-OXOPROPANOATE ; ETHYL 3-OXO-3-(4-NITROPHENYL)PROPANOATE ; 3-(4-NITRO-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER ; ETHYL 4-NITROBENZOYLACETATE ; BENZENEPROPANOIC ACID, 4-NITRO-BETA-OXO-, ETHYL ESTER ; ETHYL 2-(4-NITROBENZOYL) ACETATE ; 4-NITROBENZOYLACETIC ACID ETHYL ESTER ; ETHYL 4'-NITROBENZOYLACETATE ; ETHYL (P-NITROBENZOYL)ACETATE
MDL Number.: MFCD00007357
H bond acceptor: 6
H bond donor: 0
Smile: CCOC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-]
InChi: InChI=1S/C11H11NO5/c1-2-17-11(14)7-10(13)8-3-5-9(6-4-8)12(15)16/h3-6H,2,7H2,1H3
InChiKey: InChIKey=NGRXSVFCLHVGKU-UHFFFAOYSA-N

Property

Melting Point: 71-73 DEG C(LIT)
Comments: APPLICATION: REACTANT INVOLVED IN: SYNTHESIS OF BETA-1,3-DICARBONYL ALDEHYDES VIA OXIDATION. KNOEVENAGEL CONDENSATION USING A LYSINE CATALYST. CYCLOISOMERIZATION FO RTHE SYNTHESIS OF TRISUBSTITUTED FURANS. FLUORINATION BY HF AND IODOSYLBENZENE. INTRAMOLECULAR MICHAEL ADDITION REACTIONS FOR SYNTHESIS OF BENZYLBUTYROLACTONES. SYNTHESIS OF DIOLS VIA REDUCTION OF AROMATIC AND ALIPHATIC KETOS ESTERS. CROSS-COUPLING REACTIONS FOR STEREOSELECTIVE SYNTHESIS OF UNSYMMETRICAL 1,4-ENEDIONES
NSC 62134
RTECS: AJ1073500
UNSPSC: 12352100
WGK: 2

Safety information

WGK Germany: 2

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