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Butylbenzene

CAS No.
104-51-8
Chemical Name:
Butylbenzene
Synonyms
N-BUTYLBENZENE;butylbenzenes;1-butylbenzene;Normal Butyl Benzene;butyl-benzen;BUTYLBENZENE;1-phenylbutan;1-PHENYLBUTANE;4-Butylbenzene;Benzene,butyl-
CBNumber:
CB4181831
Molecular Formula:
C10H14
Molecular Weight:
134.22
MDL Number:
MFCD00009463
MOL File:
104-51-8.mol
MSDS File:
SDS
Last updated:2023-12-25 13:23:17

Butylbenzene Properties

Melting point -88 °C
Boiling point 183 °C(lit.)
Density 0.86 g/mL at 25 °C(lit.)
vapor density >1 (vs air)
vapor pressure 1.03 mm Hg ( 23 °C)
refractive index n20/D 1.489(lit.)
Flash point 139 °F
storage temp. 2-8°C
solubility 11.8mg/l
form Liquid
pka >14 (Schwarzenbach et al., 1993)
color Clear colorless
explosive limit 0.8-5.8%(V)
Odor Threshold 0.0085ppm
Water Solubility INSOLUBLE
Merck 14,1549
BRN 1903395
Henry's Law Constant 12.7 at 45.00 °C, 14.1 at 50.00 °C, 15.7 at 55.00 °C, 17.3 at 60.00 °C, 18.9 at 65.00 °C, 22.2 at 70.00 °C, 26.1 at 80.00 °C (static headspace-GC, Park et al., 2004)
Dielectric constant 2.4(20℃)
Stability Stable. Flammable. Incompatible with strong oxidizing agents.
InChIKey OCKPCBLVNKHBMX-UHFFFAOYSA-N
CAS DataBase Reference 104-51-8(CAS DataBase Reference)
FDA UNII S8XZ2901RZ
NIST Chemistry Reference Benzene, butyl-(104-51-8)
EPA Substance Registry System n-Butylbenzene (104-51-8)

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS02
Signal word  Warning
Hazard statements  H226
Precautionary statements  P210-P370+P378
Hazard Codes  F,T,N
Risk Statements  10-39/23/24/25-23/24/25-11-50/53
Safety Statements  16-45-36/37-7-61-60
RIDADR  UN 2709 3/PG 3
WGK Germany  3
RTECS  CY9070000
Autoignition Temperature 774 °F
TSCA  Yes
HS Code  2902 90 00
HazardClass  3
PackingGroup  III
Toxicity rat,LDLo,oral,10mL/kg (10mL/kg),LUNGS, THORAX, OR RESPIRATION: "FIBROSIS, FOCAL (PNEUMOCONIOSIS)"BLOOD: HEMORRHAGELUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA,AMA Archives of Industrial Health. Vol. 19, Pg. 403, 1959.
NFPA 704
2
1 0

Butylbenzene price More Price(26)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 8.20239 Butylbenzene for synthesis 104-51-8 100mL $80.2 2024-03-01 Buy
Sigma-Aldrich 19600 Butylbenzene analytical standard 104-51-8 10ml $149 2024-03-01 Buy
Sigma-Aldrich 19600 Butylbenzene analytical standard 104-51-8 5ml $58 2022-05-15 Buy
TCI Chemical B0713 Butylbenzene >99.0%(GC) 104-51-8 25mL $34 2024-03-01 Buy
TCI Chemical B0713 Butylbenzene >99.0%(GC) 104-51-8 100mL $86 2024-03-01 Buy
Product number Packaging Price Buy
8.20239 100mL $80.2 Buy
19600 10ml $149 Buy
19600 5ml $58 Buy
B0713 25mL $34 Buy
B0713 100mL $86 Buy

Butylbenzene Chemical Properties,Uses,Production

Chemical Properties

colourless liquid

Physical properties

Clear, colorless, liquid with a faint petroleum or gasoline-like odor similar to that of npropylbenzene. Nagata and Takeuchi (1990) reported an odor threshold concentration 8.5 ppbv.

Uses

n-Butylbenzene is an organic solvent that has been used to induce cell death in vitro and for bioconversion.

Uses

Butylbenzene undergoes oxidation to afford butyrophenone. It is used to prepare N-arylazoles via oxidant-free and selective C(sp2)-H amination reaction. It can be used in the synthesis of alkylated pentacene and ladder-type oligo(p-phenylene)s to improve solubility in common organic solvents.

Uses

Butylbenzene is used in the preparation of butyl-silica hybrid monolithic column.

Definition

ChEBI: An alkylbenzene that is benzene substituted by a butyl group at position 1.

Synthesis Reference(s)

The Journal of Organic Chemistry, 50, p. 1749, 1985 DOI: 10.1021/jo00210a035
Tetrahedron Letters, 21, p. 87, 1980 DOI: 10.1016/S0040-4039(00)93631-1

General Description

A colorless liquid. Less dense than water and insoluble in water. Flash point between 75 - 140°F. Used to make plastics and as a solvent.

Air & Water Reactions

Highly flammable. Insoluble in water.

Reactivity Profile

Vigorous reactions, sometimes amounting to explosions, can result from the contact between aromatic hydrocarbons, such as BUTYL BENZENE, and strong oxidizing agents. They can react exothermically with bases and with diazo compounds. Substitution at the benzene nucleus occurs by halogenation (acid catalyst), nitration, sulfonation, and the Friedel-Crafts reaction.

Hazard

Toxic by ingestion.

Health Hazard

Inhalation or contact with material may irritate or burn skin and eyes. Fire may produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control or dilution water may cause pollution.

Safety Profile

Mildly toxic by ingestion. Flammable when exposed to heat or flame. To fight fire, use alcohol foam, CO2, dry chemical. Incompatible with oxidizing materials. When heated to decomposition it emits acrid and irritating fumes.

Source

No MCLGs or MCLs have been proposed (U.S. EPA, 1996).
Evaporation and/or dissolution of gasoline, naphtha, coal tar, and asphalt. Identified as one of 140 volatile constituents in used soybean oils collected from a processing plant that fried various beef, chicken, and veal products (Takeoka et al., 1996).

Purification Methods

Distil butylbenzene from sodium. Wash it with small portions of conc H2SO4 until the acid is no longer coloured, then with water and aqueous Na2CO3. Dry it ( MgSO4), and distil it twice from Na, collecting the middle fraction [Vogel J Chem Soc 607 1948]. [Beilstein 5 IV 1033.]

Global( 196)Suppliers
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View Lastest Price from Butylbenzene manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
Butylbenzene pictures 2023-12-26 Butylbenzene
104-51-8
US $100.00-1.00 / KG 1KG 99% g-kg-tons, free sample is available Henan Fengda Chemical Co., Ltd
Butylbenzene pictures 2019-07-06 Butylbenzene
104-51-8
US $2.00 / kg 1kg 99% 100kg Career Henan Chemical Co
  • Butylbenzene pictures
  • Butylbenzene
    104-51-8
  • US $100.00-1.00 / KG
  • 99%
  • Henan Fengda Chemical Co., Ltd
  • Butylbenzene pictures
  • Butylbenzene
    104-51-8
  • US $2.00 / kg
  • 99%
  • Career Henan Chemical Co
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