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CAS No.: | 3360-41-6 |
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Name: | 4-Phenylbutanol |
Article Data: | 146 |
Molecular Structure: | |
Formula: | C10H14O |
Molecular Weight: | 150.221 |
Synonyms: | 1-Butanol,4-phenyl- (6CI,7CI,8CI);4-Phenyl-1-butanol;4-Phenyl-1-butyl alcohol;4-Phenylbutyl alcohol;NSC 71383;Phenbutanol;Phenylbutylalcohol;Benzenebutanol; |
EINECS: | 222-128-8 |
Density: | 0.983 g/cm3 |
Boiling Point: | 258.8 °C at 760 mmHg |
Flash Point: | 114.3 °C |
Appearance: | colourless liquid |
Hazard Symbols: | Xi, C |
Risk Codes: | 34 |
Safety: | 23-24/25-45-36/37/39-27-26 |
PSA: | 20.23000 |
LogP: | 2.00160 |
Conditions | Yield |
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With phosphate buffer; Phenyl acetate In diethyl ether for 2.75h; Ambient temperature; pig liver acetone powder; | A 5% B 100% |
Conditions | Yield |
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Stage #1: 4-Phenylbutyric acid With sodium tetrahydroborate In tetrahydrofuran at 60℃; for 0.25h; Stage #2: With iodine In tetrahydrofuran for 5h; Reagent/catalyst; | 99% |
Stage #1: 4-Phenylbutyric acid With sodium tetrahydroborate In tetrahydrofuran at 60℃; for 0.25h; Stage #2: With iodine In tetrahydrofuran for 5h; | 98.4% |
With C25H42N6Rh(1+)*CF3O3S(1-); phenylsilane In tetrahydrofuran at 30℃; for 20h; Inert atmosphere; | 96% |
4-phenyl-butan-1-ol
Conditions | Yield |
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With potassium fluoride; dihydrogen peroxide; potassium hydrogencarbonate In tetrahydrofuran; methanol at 50℃; Oxidation; | 98% |
With potassium fluoride; dihydrogen peroxide; potassium hydrogencarbonate In tetrahydrofuran; methanol at 50℃; for 6h; | 96% |
tert-butyldimethylsilyl 4-phenylbutyl ether
4-phenyl-butan-1-ol
Conditions | Yield |
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With toluene-4-sulfonic acid In methanol; dichloromethane at 20 - 25℃; for 0.333333h; Flow reactor; | 98% |
With tetrabutyl ammonium fluoride In tetrahydrofuran at 20℃; for 0.5h; Inert atmosphere; | 249 mg |
Conditions | Yield |
---|---|
With ytterbium(III) triflate In isopropyl alcohol for 12h; Deacetylation; Heating; | 95% |
With 2,2-dibutyl-1,3,2-dioxastannane; cesium fluoride In N,N-dimethyl-formamide at 20℃; for 1h; | 95% |
Conditions | Yield |
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With iron(III) sulfate; water In toluene at 110℃; for 1h; Ionic liquid; | 95% |
4-Phenyl-1-butyne
4-phenyl-butan-1-ol
Conditions | Yield |
---|---|
With 1-hydroxytetraphenylcyclopentadienyl(tetraphenyl-2,4-cyclopentadien-1-one)-μ-hydrotetracarbonyldiruthenium(II); Ru(Cp)(PPh2PytBu)2(MeCN)PF6; water In isopropyl alcohol at 70℃; for 48h; Inert atmosphere; regioselective reaction; | 95% |
With [2,2]bipyridinyl; formic acid; (η5-cyclopentadienyl) (η6-naphthalene)ruthenium hexafluorophosphate; water In tetrahydrofuran at 55℃; for 48h; | 88% |
With formic acid; F6P(1-)*C16H22N3Ru(1+); water In 1-methyl-pyrrolidin-2-one at 25℃; for 48h; Inert atmosphere; Sealed tube; | 87% |
4-phenyl-butan-1-ol
Conditions | Yield |
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With thiophenol; 1,1'-azobis(1-cyanocyclohexanenitrile) In chlorobenzene at 110℃; for 12h; | 94% |
4-phenyl-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butane
4-phenyl-butan-1-ol
Conditions | Yield |
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Stage #1: 4-phenyl-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butane With sodium perborate tetrahydrate; water In tetrahydrofuran at 40℃; for 0.0166667h; Schlenk technique; Flow reactor; Stage #2: With sodium thiosulfate In tetrahydrofuran Schlenk technique; Flow reactor; | 92% |
With sodium hydroxide; dihydrogen peroxide In tetrahydrofuran at 55℃; for 3h; | 80% |
2-(4-phenyl-butoxy)-tetrahydro-pyran
4-phenyl-butan-1-ol
Conditions | Yield |
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With indium(III) triflate In methanol; water at 0 - 20℃; for 6h; | 92% |
IUPAC Name: 4-Phenylbutan-1-ol
Synonyms of Benzenebutanol (CAS NO.3360-41-6): 4-Phenylbutanol ; AI3-11560 ; EINECS 222-128-8 ; NSC 71383 ; Phenylbutyl alcohol ; 1-Butanol, 4-phenyl- (8CI) ; 4-Phenylbutan-1-ol
CAS NO: 3360-41-6
Molecular Formula: C10H14O
Molecular Weight: 150.2176
Molecular Structure:
Product Categories: Starting Raw Materials & Intermediates ; Alcohols ; C9 to C30 ; Oxygen Compounds
H bond acceptors: 1
H bond donors: 1
Freely Rotating Bonds: 5
Polar Surface Area: 9.23 Å2
Index of Refraction: 1.522
Molar Refractivity: 46.6 cm3
Molar Volume: 152.7 cm3
Surface Tension: 38.3 dyne/cm
Density of Benzenebutanol (CAS NO.3360-41-6): 0.983 g/cm3
Flash Point: 114.3 °C
Enthalpy of Vaporization: 52.45 kJ/mol
Boiling Point: 258.8 °C at 760 mmHg
Vapour Pressure: 0.00686 mmHg at 25°C
Hazard Codes of Benzenebutanol (CAS NO.3360-41-6): Xi,C
Risk Statements: 34
R34: Causes burns.
Safety Statements: 23-24/25-45-36/37/39-27-26
S23: Do not breathe vapour.
S24/25: Avoid contact with skin and eyes.
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.
S27: Take off immediately all contaminated clothing.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
WGK Germany: 3
RTECS: 222-128-8
HS Code: 29062900