| Identification | More | [Name]
4-Butoxyphenol | [CAS]
122-94-1 | [Synonyms]
4-BUTOXYPHENOL
4-BUTYLOXYPHENOL
4-N-BUTOXYPHENOL
4-N-BUTYLOXYPHENOL
4-NORMAL-BUTOXYPHENOL
HYDROQUINONE MONOBUTYL ETHER
HYDROQUINONE MONO-N-BUTYL ETHER
P-BUTOXYPHENOL
4-butoxy-pheno
Phenol, 4-butoxy-
Phenol, p-butoxy-
4-Buthoxy phenol
PARA-BUTOXYPHENOL
4-N-BUTOXYPHENOL =99.0% | [EINECS(EC#)]
204-583-4 | [Molecular Formula]
C10H14O2 | [MDL Number]
MFCD00002336 | [Molecular Weight]
166.22 | [MOL File]
122-94-1.mol |
| Chemical Properties | Back Directory | [Appearance]
PALE BROWN TO BROWN CRYSTALLINE POWDER | [Melting point ]
65-66 °C(lit.) | [Boiling point ]
165 °C / 2mmHg | [density ]
1.0060 (rough estimate) | [refractive index ]
1.5200 (estimate) | [storage temp. ]
Inert atmosphere,Room Temperature | [solubility ]
Soluble in acetone and ethanol. | [form ]
Solid | [pka]
10.33±0.15(Predicted) | [color ]
Light Brown to Brown | [Usage]
Intermediates of Liquid Crystals | [Detection Methods]
HPLC | [InChI]
InChI=1S/C10H14O2/c1-2-3-8-12-10-6-4-9(11)5-7-10/h4-7,11H,2-3,8H2,1H3 | [InChIKey]
MBGGFXOXUIDRJD-UHFFFAOYSA-N | [SMILES]
C1(O)=CC=C(OCCCC)C=C1 | [CAS DataBase Reference]
122-94-1(CAS DataBase Reference) | [NIST Chemistry Reference]
P-butoxyphenol(122-94-1) | [EPA Substance Registry System]
122-94-1(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn,Xi,T | [Risk Statements ]
R22:Harmful if swallowed.
R37/38:Irritating to respiratory system and skin .
R40:Limited evidence of a carcinogenic effect.
R41:Risk of serious damage to eyes.
R43:May cause sensitization by skin contact.
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R42/43:May cause sensitization by inhalation and skin contact .
R36/37/38:Irritating to eyes, respiratory system and skin .
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R45:May cause cancer. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S53:Avoid exposure-obtain special instruction before use .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S22:Do not breathe dust . | [RIDADR ]
2811 | [WGK Germany ]
3
| [TSCA ]
Yes | [HS Code ]
29095000 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral |
| Hazard Information | Back Directory | [Chemical Properties]
PALE BROWN TO BROWN CRYSTALLINE POWDER | [Uses]
Intermediates of Liquid Crystals | [Uses]
It is an intermediate of liquid crystals. | [Uses]
Pramoxine impurity. Phenol derivatives induced tumor cell apoptosis. | [Definition]
ChEBI: 4-Butoxyphenol is an aromatic ether. | [Synthesis]
General procedure for the synthesis of 4-n-butoxyphenol from 1-butoxy-4-iodobenzene: To a stirred solution containing CuI (19.0 mg, 10 mol%) and dimethylethylenedioxime (L6; 23.2 mg, 20 mol%) were added, in order, aryl halide (1 mmol), CsOH (3 mmol), and H2O (1 mL) over a period of 0.1 hours. The reaction mixture was stirred in DMSO (1 mL) at 120 °C (for aryl iodides) or the corresponding temperature (for aryl bromides). The reaction progress was monitored by TLC (EtOAc-hexane). Upon completion of the reaction, the mixture was cooled to room temperature and acidified with 0.5 M HCl (0.5 mL). The resulting mixture was extracted with EtOAc (3 × 10 mL) and the organic phase was dried with Na2SO4. After evaporation of the solvent, the residue obtained was purified by column chromatography. | [References]
[1] Journal of Chemical Sciences, 2018, vol. 130, # 2, |
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