Home Aldehydes 2-Phenylpropionaldehyde

2-Phenylpropionaldehyde

CAS No.:
93-53-8
Catalog Number:
AG003B9L
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98%(GC)
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United States
$86
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Product Description
Catalog Number:
AG003B9L
Chemical Name:
2-Phenylpropionaldehyde
CAS Number:
93-53-8
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
MDL Number:
MFCD00006973
IUPAC Name:
2-phenylpropanal
InChI:
InChI=1S/C9H10O/c1-8(7-10)9-5-3-2-4-6-9/h2-8H,1H3
InChI Key:
IQVAERDLDAZARL-UHFFFAOYSA-N
SMILES:
O=CC(c1ccccc1)C
EC Number:
202-255-5
NSC Number:
5231
FEMA Number:
2886
Properties
Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.073g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.178g/mol
Monoisotopic Mass:
134.073g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
(R,S)-2-chlorophenoxyl pyrazolides as novel substrates for improving lipase-catalyzed hydrolytic resolution. Chirality 20120101
Characterization and further stabilization of a new anti-prelog specific alcohol dehydrogenase from Thermus thermophilus HB27 for asymmetric reduction of carbonyl compounds. Bioresource technology 20120101
A computational reinvestigation of the formation of N-alkylpyrroles via intermolecular redox amination. Organic letters 20111118
A site-saturated mutagenesis study of pentaerythritol tetranitrate reductase reveals that residues 181 and 184 influence ligand binding, stereochemistry and reactivity. Chembiochem : a European journal of chemical biology 20110321
Formation of multi-stereogenic centers using a catalytic diastereoselective Henry reaction. Chemical communications (Cambridge, England) 20101114
Origin of pressure effects on regioselectivity and enantioselectivity in the rhodium-catalyzed hydroformylation of styrene with (S,S,S)-BisDiazaphos. Journal of the American Chemical Society 20100804
The development and evaluation of a conducting matrix for the electrochemical regeneration of the immobilised co-factor NAD(H) under continuous flow. Organic & biomolecular chemistry 20100521
Emission pattern of semi-volatile organic compounds from recycled styrenic polymers using headspace solid-phase microextraction gas chromatography-mass spectrometry. Journal of chromatography. A 20100115
Halonium ion-assisted deiodination of styrene-based vicinal iodohydrins followed by rearrangement through phenyl migration. The Journal of organic chemistry 20091016
Substrate specificity of human and yeast aldehyde dehydrogenases. Chemico-biological interactions 20090316
Modifications of antiepileptic drugs for improved tolerability and efficacy. Perspectives in medicinal chemistry 20080101
Loading-washout studies of the stereoselective sinusoidal uptake of (R)- and (s)-2-phenylpropionyl acyl glucuronide. Current drug metabolism 20061001
Stability and comparative metabolism of selected felbamate metabolites and postulated fluorofelbamate metabolites by postmitochondrial suspensions. Chemical research in toxicology 20051201
Can the pi-facial selectivity of solvation be predicted by atomistic simulation? Journal of the American Chemical Society 20050803
Combinations of chiral and prochiral singlet radical-pairs in reaction cavities of polyethylene films. Control and analysis of radical tumbling and translation. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20050401
Inversion of stereoselectivity by applying mutants of the hydroxynitrile lyase from Manihot esculenta. Chembiochem : a European journal of chemical biology 20050401
Investigating the role of 2-phenylpropenal in felbamate-induced idiosyncratic drug reactions. Chemical research in toxicology 20041201
Reversal of enantioselectivity in the hydroformylation of styrene with [2S,4S-BDPP]Pt(SnCl3)Cl at high temperature arises from a change in the enantioselective-determining step. Journal of the American Chemical Society 20040505
Cumene oxidation by cis-[RuIV(bpy)2(py)(O)]2+, revisited. Inorganic chemistry 20040223
Chiral aldehydes in hydrocarbons: diastereoselective nucleophilic addition, NMR, and CD spectroscopy reveal dynamic solvation effects. Chirality 20040101
Reductive activation of dioxygen by a myoglobin reconstituted with a flavohemin. Journal of the American Chemical Society 20020925
Interaction between human serum albumin and the felbamate metabolites 4-Hydroxy-5-phenyl-[1,3]oxazinan-2-one and 2-phenylpropenal. Chemical research in toxicology 20020601
Role of glutathione S-transferases A1-1, M1-1, and P1-1 in the detoxification of 2-phenylpropenal, a reactive felbamate metabolite. Chemical research in toxicology 20010501
Properties