| Identification | More | [Name]
4-Phenylbutanol | [CAS]
3360-41-6 | [Synonyms]
4-PHENYL-1-BUTANOL
4-PHENYL BUTANOL
4-PHENYLBUTANOL-1
4-PHENYLBUTYL ALCOHOL
4-PHENYL-N-BUTANOL
benzenebutanol
1-Butanol, 4-phenyl-
Phenylbutyl alcohol
4-phenylbutan-1-ol
4-Phenyl-1-1butanol
4-Hexyl-1-butanol
4-PHENYL-1-BUSTANOL
1-Phenyl-4-butanol
4-PHENYL-1-BROMOBUTANE
4-PHENYL-1-BUTANOLSALMETEROL | [EINECS(EC#)]
222-128-8 | [Molecular Formula]
C10H14O | [MDL Number]
MFCD00002971 | [Molecular Weight]
150.22 | [MOL File]
3360-41-6.mol |
| Chemical Properties | Back Directory | [Appearance]
colourless liquid | [Boiling point ]
140-142 °C14 mm Hg(lit.)
| [density ]
0.984 g/mL at 20 °C(lit.)
| [refractive index ]
n20/D 1.521(lit.)
| [Fp ]
>230 °F
| [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Chloroform | [form ]
Liquid | [pka]
15.13±0.10(Predicted) | [color ]
Clear colorless | [Odor]
at 100.00 %. rose | [Stability:]
Stable. Combustible. Incompatible with strong oxidizing agents. | [Odor Type]
floral | [BRN ]
2042122 | [InChIKey]
LDZLXQFDGRCELX-UHFFFAOYSA-N | [LogP]
2.350 | [CAS DataBase Reference]
3360-41-6(CAS DataBase Reference) | [NIST Chemistry Reference]
Benzenebutanol(3360-41-6) | [EPA Substance Registry System]
3360-41-6(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi,C | [Risk Statements ]
R34:Causes burns. | [Safety Statements ]
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where 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 | [TSCA ]
Yes | [HS Code ]
29062900 |
| Hazard Information | Back Directory | [Chemical Properties]
colourless liquid | [Uses]
4-Phenyl-1-butanol is used as a reagent in the synthesis of substituted pyrrolidine-2-carboxylic acids which are used in the treatment of AT2 receptor function associated diseases. | [Production Methods]
4-Phenylbutanol can be produced 1) from Phenylacetaldehyde and Acetaldehyde by condensation, followed by hydrogenation and reduction of the unsaturated aldehyde.
2) from Phenylethyl magnesiumbromide plus
Ethylene oxide in a Grignard type reaction. | [Synthesis Reference(s)]
Chemical and Pharmaceutical Bulletin, 31, p. 2607, 1983 DOI: 10.1248/cpb.31.2607
Journal of the American Chemical Society, 73, p. 124, 1951 DOI: 10.1021/ja01145a045 | [General Description]
4-Phenyl-1-butanol is oxidized by ceric ammonium nitrate in acetonitrile to afford 2-phenyltetrahydrofuran. It undergoes cyclization in presence of phosphoric acid at high temperature to yield tetralin. |
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