| Identification | More | [Name]
Butoxybenzene | [CAS]
1126-79-0 | [Synonyms]
BUTOXYBENZENE
BUTYL PHENYL ETHER
N-BUTOXYBENZENE
N-BUTYL PHENYL ETHER
1-Phenoxybutane
Benzene, butoxy-
butoxy-benzen
butoxyphenyl
Ether, butyl phenyl
ether,butylphenyl
Phenyl butyl ether
n-Butoxybenzene (n-Butyl phenyl ether)
butyl phenolate
1-butyl phenyl ether | [EINECS(EC#)]
214-426-1 | [Molecular Formula]
C10H14O | [MDL Number]
MFCD00009438 | [Molecular Weight]
150.22 | [MOL File]
1126-79-0.mol |
| Chemical Properties | Back Directory | [Appearance]
CLEAR COLOURLESS LIQUID | [Melting point ]
−19 °C(lit.) | [Boiling point ]
210.3 °C(lit.) | [density ]
0.935 g/mL at 25 °C(lit.)
| [vapor pressure ]
84Pa at 25℃ | [refractive index ]
n20/D 1.497(lit.)
| [Fp ]
180 °F
| [storage temp. ]
Store at room temperature | [form ]
clear liquid | [color ]
Colorless to Light yellow | [Specific Gravity]
0.935 | [Odor]
at 10.00 % in dipropylene glycol. anise licorice | [Odor Type]
licorice | [Water Solubility ]
36.6mg/L at 20℃ | [BRN ]
1635559 | [Dielectric constant]
3.73 | [InChI]
1S/C10H14O/c1-2-3-9-11-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3 | [InChIKey]
YFNONBGXNFCTMM-UHFFFAOYSA-N | [SMILES]
CCCCOc1ccccc1 | [LogP]
4.26 at 30℃ | [CAS DataBase Reference]
1126-79-0(CAS DataBase Reference) | [NIST Chemistry Reference]
Butoxybenzene(1126-79-0) | [EPA Substance Registry System]
1126-79-0(EPA Substance) |
| Safety Data | Back Directory | [Hazard Codes ]
N | [Risk Statements ]
51/53 | [Safety Statements ]
S24/25:Avoid contact with skin and eyes . | [RIDADR ]
UN3082 - class 9 - PG 3 - DOT NA1993 - Environmentally hazardous substances, liquid, n.o.s. HI: all (not BR) | [WGK Germany ]
2
| [RTECS ]
KN5300000
| [TSCA ]
Yes | [REACH Registrations]
Active | [HazardClass ]
9 | [HS Code ]
29093090 | [Storage Class]
10 - Combustible liquids | [Hazard Classifications]
Eye Irrit. 2 | [Safety Profile]
Moderately toxic by
ingestion. See also ETHERS. When heated
to decomposition it emits acrid and irritating
fumes. | [Toxicity]
mouse,LD50,oral,3200mg/kg (3200mg/kg),BEHAVIORAL: TREMORBEHAVIORAL: EXCITEMENTBEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD,Journal of Pharmacology and Experimental Therapeutics. Vol. 88, Pg. 400, 1946. |
| Hazard Information | Back Directory | [Chemical Properties]
CLEAR COLOURLESS LIQUID | [Uses]
Butyl phenyl ether was used as model compound to study the transformation of human pharmaceuticals detected in water during chlorine disinfection. It was used in the synthesis of amino acids with aryl-keto function in their side-chains. | [Synthesis Reference(s)]
Journal of the American Chemical Society, 96, p. 2829, 1974 DOI: 10.1021/ja00816a027 | [Purification Methods]
Dissolve it in diethyl ether, washed first with 10% aqueous NaOH to remove traces of phenol, then repeatedly with distilled water, followed by evaporation of the solvent and distillation under reduced pressure [Arnett & Wu J Am Chem Soc 82 5660 1960]. [Beilstein 6 H 143, 6 I 82, 6 II 145, 6 III 550, 6 IV 558.] |
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