ChemicalBook--->CAS DataBase List--->1126-79-0

1126-79-0

1126-79-0 Structure

1126-79-0 Structure
IdentificationMore
[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 PropertiesBack 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
[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
[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 DataBack 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
[HS Code ]

29093090
[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.
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1-Bromobutane
[Preparation Products]

Ethanone, 2-bromo-1-(4-butoxyphenyl)--->Benzeneacetic acid, 4-butoxy-α-oxo-, ethyl ester-->Dyclonine Impurity 3-->1-Butoxy-4-iodobenzene
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Butoxybenzene(1126-79-0).msds
Hazard InformationBack 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.]
Spectrum DetailBack Directory
[Spectrum Detail]

Butoxybenzene(1126-79-0)MS
Butoxybenzene(1126-79-0)1HNMR
Butoxybenzene(1126-79-0)13CNMR
Butoxybenzene(1126-79-0)IR1
Butoxybenzene(1126-79-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

n-Butyl phenyl ether, 99%(1126-79-0)
[Alfa Aesar]

n-Butyl phenyl ether, 99%(1126-79-0)
[Sigma Aldrich]

1126-79-0(sigmaaldrich)
[TCI AMERICA]

Butyl Phenyl Ether,>99.0%(GC)(1126-79-0)
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