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111309

Sigma-Aldrich

1-Phenyl-1-propanol

≥97%

Sinônimo(s):

α-Ethylbenzyl alcohol, (±)-1-Phenylpropanol

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50 G
R$ 319,00

R$ 319,00

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50 G
R$ 319,00

About This Item

Fórmula linear:
C2H5CH(C6H5)OH
Número CAS:
93-54-9
Peso molecular:
136.19
Beilstein:
1906759
Número CE:
202-256-0
Número MDL:
MFCD00004564
Código UNSPSC:
12352100
eCl@ss:
39023126
ID de substância PubChem:
24847022
NACRES:
NA.22

R$ 319,00

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Ensaio

≥97%

índice de refração

n20/D 1.52 (lit.)

p.e.

103 °C/14 mmHg (lit.)

densidade

0.994 g/mL at 25 °C (lit.)

grupo funcional

hydroxyl
phenyl

cadeia de caracteres SMILES

CCC(O)c1ccccc1

InChI

1S/C9H12O/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3

chave InChI

DYUQAZSOFZSPHD-UHFFFAOYSA-N

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Descrição geral

1-Phenyl-1-propanol enantiomers (E-PP) forms the inclusion complexes of cyclic decapeptide (CDP) which were studied using the density functional theory (DFT) B3LYP method[1]. It was also used to determine the mass transfer kinetics effect on the elution profiles of the 1-phenyl-1-propanol (PP) enantiomers on Chiracel OB (cellulose tribenzoate coated on silica gel)[2].

Pictogramas

Exclamation mark
GHS07

Palavra indicadora

Warning

Frases de perigo

H302

Declarações de precaução

P264 - P270 - P301 + P312 - P501

Classificações de perigo

Acute Tox. 4 Oral

Código de classe de armazenamento

10 - Combustible liquids

Classe de risco de água (WGK)

WGK 3

Ponto de fulgor (°F)

194.0 °F - closed cup

Ponto de fulgor (°C)

90 °C - closed cup

Equipamento de proteção individual

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificados de análise (COA)

Lot/Batch Number
SHBR9220
SHBP1868
SHBQ1173
SHBN9218
SHBM1743

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Hongge Zhao et al.
Journal of molecular modeling, 18(3), 851-858 (2011-06-01)
Cyclic peptides are exciting novel hosts for chiral and molecular recognition. In this work, the inclusion complexes of cyclic decapeptide (CDP) with the 1-phenyl-1-propanol enantiomers (E-PP) are firstly studied using the density functional theory (DFT) B3LYP method. Our calculated results
S Khattabi et al.
Journal of chromatography. A, 877(1-2), 95-107 (2000-06-14)
Using single-step frontal analysis, we measured single-component and competitive adsorption isotherm data for the two enantiomers of 1-phenyl-1-propanol (PP). These experimental data were fitted to several competitive bi-Langmuir models (with 8, 6, 5 and 4 parameters) and to the competitive
Arvind Rajendran et al.
Journal of chromatography. A, 1076(1-2), 183-188 (2005-06-25)
The supercritical fluid chromatography (SFC) separation of the enantiomers of 1-phenyl-1-propanol on the chiral stationary phase Chiralcel OD under linear conditions is studied. Supercritical CO2 modified with methanol is used as a mobile phase. The effect of modifier concentration, pressure
Anna M Costa et al.
Journal of the American Chemical Society, 124(24), 6929-6941 (2002-06-13)
The optimization of asymmetric catalysts for enantioselective synthesis has conventionally revolved around the synthesis and screening of enantiopure ligands. In contrast, we have optimized an asymmetric reaction by modification of a series of achiral ligands. Thus, employing (S)-3,3'-diphenyl BINOL [(S)-Ph(2)-BINOL]
Stefan Ottiger et al.
Journal of chromatography. A, 1162(1), 74-82 (2007-02-17)
The separation of the enantiomers of 1-phenyl-1-propanol by supercritical fluid chromatography on a chiral stationary phase, which consists of cellulose tris (3,5-dimethylphenylcarbamate) coated on a silica support (Chiralcel-OD), is studied under overloaded, non-linear chromatographic conditions. Pulse experiments are performed at
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