Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C8H10O |
| Molecular Weight | 122.1644 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COCC1=CC=CC=C1
InChI
InChIKey=GQKZBCPTCWJTAS-UHFFFAOYSA-N
InChI=1S/C8H10O/c1-9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
| Molecular Formula | C8H10O |
| Molecular Weight | 122.1644 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Visible light flavin photo-oxidation of methylbenzenes, styrenes and phenylacetic acids. | 2010-10-28 |
|
| Structural elaboration of the surprising ortho-zincation of benzyl methyl ether. | 2010-04-07 |
|
| Dapdiamides, tripeptide antibiotics formed by unconventional amide ligases. | 2010-03-26 |
|
| Synthesis of marine polycyclic polyethers via endo-selective epoxide-opening cascades. | 2010-03-19 |
|
| Design and synthesis of potent and selective BACE-1 inhibitors. | 2010-02-25 |
|
| The Catalytic Function of Nonheme Iron (III) Complex for Hydrocarbon Oxidation. | 2010 |
|
| Interpretable correlation descriptors for quantitative structure-activity relationships. | 2009-12-24 |
|
| Organic-soluble antimicrobial silver nanoparticle-polymer composites in gram scale by one-pot synthesis. | 2009-11 |
|
| 6-methyl-2,4-disubstituted pyridazin-3(2H)-ones: a novel class of small-molecule agonists for formyl peptide receptors. | 2009-08-27 |
|
| Remarkable effect of 2,2'-bipyridyl: mild and highly chemoselective deprotection of methoxymethyl (MOM) ethers in combination with TMSOTf (TESOTf)-2,2'-bipyridyl. | 2009-08-07 |
|
| Stereodirecting effect of the pyranosyl C-5 substituent in glycosylation reactions. | 2009-07-17 |
|
| Novel synthesis of methoxymethyl benzene by electrochemical coupling reaction of toluene with methanol in ionic liquid media. | 2009-06-15 |
|
| 1-(4-Methoxy-phen-yl)-3-phenyl-1H-pyrazol-5-amine. | 2009-04-30 |
|
| Isolation and detection of steroids from human urine by molecularly imprinted solid-phase extraction and liquid chromatography. | 2009-04-15 |
|
| Characterization of activity landscapes using 2D and 3D similarity methods: consensus activity cliffs. | 2009-02 |
|
| Collision-induced loss of AgH from Ag+ adducts of alkylamines, aminocarboxylic acids and alkyl benzyl ethers leads exclusively to thermodynamically favored product ions. | 2009-02 |
|
| Design, synthesis and SAR of potent statine-based BACE-1 inhibitors: exploration of P1 phenoxy and benzyloxy residues. | 2008-11-01 |
|
| Penta-carbonyl-2κC-chlorido-1κCl-bis-[1(η)-cyclo-penta-dien-yl][μ(2)-oxido(meth-yl)methyl-ene-1:2κO:C]tungsten(0)zirconium(IV). | 2008-09-06 |
|
| Gas chromatography-mass spectrometry analysis of regioisomeric ring substituted methoxy methyl phenylacetones. | 2007-09 |
|
| Synthesis and biological evaluation of phosphate prodrugs of 4-phospho-D-erythronohydroxamic acid, an inhibitor of 6-phosphogluconate dehydrogenase. | 2007-08 |
|
| The Characterization and Imaging Behavior of a New Developed Paramagnetic Contrast Agent NMG2[Gd(TTDA-BOM)]. | 2007-02-07 |
|
| Dissociative protonation sites: reactive centers in protonated molecules leading to fragmentation in mass spectrometry. | 2006-07-21 |
|
| Synthesis and physicochemical characterization of two gadolinium(III) TTDA-like complexes and their interaction with human serum albumin. | 2006-01-09 |
|
| Conformational preferences and enantiodiscrimination of phosphino-4-(1-hydroxyalkyl)oxazoline-metal-olefin complexes resulting from an OH-metal hydrogen bond. | 2005-11-25 |
|
| Heterocycles by PtCl2-catalyzed intramolecular carboalkoxylation or carboamination of alkynes. | 2005-11-02 |
|
| Benzyl ether structure-activity relationships in a series of ketopiperazine-based renin inhibitors. | 2005-11-01 |
|
| An unexpected two-group migration involving a sulfonynamide to nitrile rearrangement. Mechanistic studies of a thermal N --> C tosyl rearrangement. | 2005-03-03 |
|
| Biradicals/zwitterions from thermolysis of enyne-isocyanates. Application to the synthesis of 2(1H)-pyridones, benzofuro[3,2-c]pyridin-1(2H)-ones, 2,5-dihydro-1H-pyrido[4,3-b]indol-1-ones, and related compounds. | 2004-06-25 |
|
| Ring opening of nucleoside 1',2'-epoxides with organoaluminum reagents: stereoselective entry to ribonucleosides branched at the anomeric position. | 2004-03-19 |
|
| Synthesis and anti-HIV-1 activity of novel 10-thiaisoalloxazines, a structural analog of C-5 and/or C-6 substituted pyrimidine acyclonucleoside. | 2003-06 |
|
| Analysis of two polymorphic forms of a pyrido[2,3-d]pyrimidine N9-C10 reversed-bridge antifolate binary complex with human dihydrofolate reductase. | 2003-04 |
|
| A ring walk of methylene groups in toluene radical cations. An extension of the toluene-cycloheptatriene rearrangement of aromatic radical cations. Theory and experiment. | 2003 |
|
| 16-[3-Methoxy-4-(2-piperidin-1-ylethoxy)benzylidene]-17-oxoandrost-5-en-3beta-yl acetate monohydrate. | 2002-12 |
|
| Analysis of quinazoline and pyrido[2,3-d]pyrimidine N9-C10 reversed-bridge antifolates in complex with NADP+ and Pneumocystis carinii dihydrofolate reductase. | 2002-09 |
|
| The deprotonation of benzyl alcohol radical cations: a mechanistic dichotomy in the gas phase as in solution. | 2002-01-18 |
|
| An experimental and computational evaluation of the energetics of the isomeric methoxyphenylcarbenes generated in carbon atom reactions. | 2002-01-16 |
|
| Relaxometric evaluation of novel manganese(II) complexes for application as contrast agents in magnetic resonance imaging. | 2002-01 |
|
| Two ethyl 2-deoxy-alpha-D-hexo-3,7-pyranoso-3-octulosonate derivatives. | 2001-12 |
|
| Chlorometabolite production by the ecologically important white rot fungus Bjerkandera adusta. | 2001-09 |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:18:29 GMT 2025
by
admin
on
Mon Mar 31 21:18:29 GMT 2025
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| Record UNII |
F22RLS78BD
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| Record Status |
Validated (UNII)
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| Record Version |
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m2413
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