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Details

Stereochemistry ACHIRAL
Molecular Formula C9H8O3
Molecular Weight 164.158
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL PHENYLGLYOXALATE

SMILES

COC(=O)C(=O)C1=CC=CC=C1

InChI

InChIKey=YLHXLHGIAMFFBU-UHFFFAOYSA-N
InChI=1S/C9H8O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6H,1H3

HIDE SMILES / InChI

Molecular Formula C9H8O3
Molecular Weight 164.158
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
The [2+2]-photocycloaddition of aromatic aldehydes and ketones to 3,4-dihydro-2-pyridones: regioselectivity, diastereoselectivity, and reductive ring opening of the product oxetanes.
2001 Oct 15
Atropoisomeric quinolinium salt promoting the access to both enantiomeric forms of methyl mandelate: a versatile NADH mimic.
2002 Oct 7
Stereoselective generation of vicinal stereogenic quaternary centers by photocycloaddition of 5-methoxy oxazoles to alpha-keto esters: synthesis of erythro beta-hydroxy dimethyl aspartates.
2004 Apr 21
Unusual temperature dependence of enantioselectivity in asymmetric reductions by chiral NADH models.
2006 May 11
Exploiting nanospace for asymmetric catalysis: confinement of immobilized, single-site chiral catalysts enhances enantioselectivity.
2008 Jun
[Overview of 40 years' chemical study].
2009 Jan
Mechanistic insights on the magnesium(II) ion-activated reduction of methyl benzoylformate with chelated NADH peptide beta-lactam models.
2009 Sep 4
Integration of newly isolated biocatalyst and resin-based in situ product removal technique for the asymmetric synthesis of (R)-methyl mandelate.
2010 Sep
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 04:55:42 GMT 2023
Edited
by admin
on Sat Dec 16 04:55:42 GMT 2023
Record UNII
23F2045STG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL PHENYLGLYOXALATE
Systematic Name English
METHYL .ALPHA.-OXOBENZENEACETATE
Systematic Name English
GLYCOPYRRONIUM BROMIDE IMPURITY H [EP IMPURITY]
Common Name English
BENZENEACETIC ACID, .ALPHA.-OXO-, METHYL ESTER
Common Name English
METHYL 2-OXO-2-PHENYLACETATE
Systematic Name English
METHYL BENZOYLFORMATE
INCI  
INCI  
Official Name English
METHYL BENZOYLFORMATE [INCI]
Common Name English
METHOXYCARBONYL PHENYL KETONE
Systematic Name English
METHYL PHENYL-.ALPHA.-OXOACETATE
Systematic Name English
METHYL PHENYLGLYOXYLATE
Systematic Name English
2-OXO-2-PHENYLACETIC ACID METHYL ESTER
Systematic Name English
NSC-409881
Code English
BENZOYLFORMIC ACID METHYL ESTER
Systematic Name English
NSC-171206
Code English
METHYL PHENYLOXOACETATE
Systematic Name English
METHYL OXOPHENYLACETATE
Systematic Name English
METHYL 2-PHENYL-2-OXOACETATE
Systematic Name English
PHENYLGLYOXYLIC ACID METHYL ESTER
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID9065867
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
CHEBI
84256
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
ECHA (EC/EINECS)
239-263-3
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
CAS
15206-55-0
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
FDA UNII
23F2045STG
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
NSC
409881
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
NSC
171206
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
PUBCHEM
84835
Created by admin on Sat Dec 16 04:55:43 GMT 2023 , Edited by admin on Sat Dec 16 04:55:43 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY