Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C9H12O |
| Molecular Weight | 136.191 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(CO)C1=CC=CC=C1
InChI
InChIKey=RNDNSYIPLPAXAZ-UHFFFAOYSA-N
InChI=1S/C9H12O/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Experimental investigation of the Jahn-Teller effect in the ground and excited electronic states of the tropyl radical. Part II. Vibrational analysis of the A 2E"3-X 2E"2 electronic transition. | 2008-02-28 |
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| Computational investigation of the Jahn-Teller effect in the ground and excited electronic states of the tropyl radical. Part I. Theoretical calculation of spectroscopically observable parameters. | 2008-02-28 |
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| [Study on enantioselectivity of celluloses derived by phenylcarbamate at 2,3- or 2,3,6-positions]. | 2007-03 |
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| Asymmetric resolution in ester reduction by NaBH4 at the interface of aqueous aggregates of amino acid, peptide, and chiral-counterion-based cationic surfactants. | 2006-12-18 |
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| Pseudorotation-driven dynamical structure of the tropyl radical. | 2006-10-28 |
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| Chromatographic separation of phenylpropanol enantiomers on a quinidine carbamate-type chiral stationary phase. | 2005-10-14 |
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| Water dependent properties of cutinase in nonaqueous solvents: a computational study of enantioselectivity. | 2005-08 |
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| Poly(ethylene glycol)-lipase complexes that are highly active and enantioselective in ionic liquids. | 2004-04-21 |
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| Effect of immobilization support, water activity, and enzyme ionization state on cutinase activity and enantioselectivity in organic media. | 2004-02-20 |
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| Infrared spectroscopy of neutral C7H7 isomers: benzyl and tropyl. | 2003-12-24 |
|
| Active site characteristics of CYP4B1 probed with aromatic ligands. | 2001-07-24 |
|
| Enantioselective metabolism of cumene. | 1992-11 |
|
| [Cleavage of 2-phenylpropan-1-ol and 2-phenylpropan-2-ol-glucuronide, 2 metabolites of isopropylbenzol (Cumol)]. | 1986 |
Patents
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C439395
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1447
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DTXSID8037756
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214-379-7
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1123-85-9
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5232
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SUBSTANCE RECORD
