phenyl propanol

Modify Date: 2024-01-02 23:46:25

phenyl propanol Structure
phenyl propanol structure
Common Name phenyl propanol
CAS Number 93-54-9 Molecular Weight 136.191
Density 1.0±0.1 g/cm3 Boiling Point 219.0±8.0 °C at 760 mmHg
Molecular Formula C9H12O Melting Point N/A
MSDS Chinese USA Flash Point 90.6±0.0 °C
Symbol GHS07
GHS07
Signal Word Warning

 Use of phenyl propanol


1-Phenyl-1-propanol is used as a chiral building block and synthetic intermediate in the pharmaceutical industries. 1-Phenyl-1-propanol is an intermediate of anti-depressant drug Fluoxetine[1][2].

 Names

Name 1-Phenyl-1-propanol
Synonym More Synonyms

 phenyl propanol Biological Activity

Description 1-Phenyl-1-propanol is used as a chiral building block and synthetic intermediate in the pharmaceutical industries. 1-Phenyl-1-propanol is an intermediate of anti-depressant drug Fluoxetine[1][2].
Related Catalog
References

[1]. Soyer A, et al. Optimization of lipase-catalyzed enantioselective production of 1-phenyl 1-propanol using response surface methodology. Prep Biochem Biotechnol. 2010;40(4):389-404.

[2]. Xavier S, et al. NBO, conformational, NLO, HOMO-LUMO, NMR and electronic spectral study on 1-phenyl-1-propanol by quantum computational methods. Spectrochim Acta A Mol Biomol Spectrosc. 2015;137:306-320.

 Chemical & Physical Properties

Density 1.0±0.1 g/cm3
Boiling Point 219.0±8.0 °C at 760 mmHg
Molecular Formula C9H12O
Molecular Weight 136.191
Flash Point 90.6±0.0 °C
Exact Mass 136.088821
PSA 20.23000
LogP 1.91
Vapour Pressure 0.1±0.5 mmHg at 25°C
Index of Refraction 1.525
Water Solubility insoluble

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DO5470000
CHEMICAL NAME :
Benzyl alcohol, alpha-ethyl-
CAS REGISTRY NUMBER :
93-54-9
BEILSTEIN REFERENCE NO. :
1906759
LAST UPDATED :
199706
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C9-H12-O
MOLECULAR WEIGHT :
136.21
WISWESSER LINE NOTATION :
QY2&R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 116,154,1958
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
700 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 116,154,1958

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes Xn:Harmful;
Risk Phrases R22
Safety Phrases S23-S24/25
RIDADR 2810
WGK Germany 3
RTECS DO5470000
HS Code 2942000000

 Synthetic Route

 Customs

HS Code 2906299090
Summary 2906299090 other aromatic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

 Articles10

More Articles
Purification and characterization of 2-aminoacetophenone reductase of newly isolated Burkholderia sp. YT.

J. Biosci. Bioeng. 104(5) , 416-9, (2007)

We found that a newly isolated Burkholderia sp. produced (R)-2-amino-1-phenylethanol from 2-aminoacetophenone, showing the high stereospecificity. NADPH-dependent 2-aminoacetophenone reductase purifie...

Study of the adsorption behavior of the enantiomers of 1-phenyl-1-propanol on a cellulose-based chiral stationary phase.

J. Chromatogr. A. 877(1-2) , 95-107, (2000)

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 se...

Density functional theory studies on the inclusion complexes of cyclic decapeptide with 1-phenyl-1-propanol enantiomers.

J. Mol. Model. 18(3) , 851-8, (2012)

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 fir...

 Synonyms

1-phenylpropan-1-ol
1-phenylpropanol
α-ethylbenzyl alcohol
EINECS 202-256-0
Benzenemethanol, α-ethyl-
Ejibil
Choleda
Fepar
Fenicol
SH261
1-Phenyl-1-propanol
rac-1-phenyl-1-propanol
Unichol
phenyl propanol
Felicur
Livonal
1-phenylpropyl alcohol
Bilergon
MFCD00004564
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