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1-Bromo-3-methylbutane, also known as isopentyl bromide, is an alkyl halide and organic synthesis reagent. It is a colorless liquid with a flash point of 21°F, slightly soluble in water, and denser than water. Its vapors are heavier than air, and it is characterized by its clear colorless appearance.

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  • 107-82-4 Structure
  • Basic information

    1. Product Name: 1-Bromo-3-methylbutane
    2. Synonyms: 1-bromo-3-methyl-butan;2-methyl-4-bromobutane;3-Methyl-1-bromobutane;3-Methylbutylbromid;4-Bromo-2-methylbutane;BrCH2CH2CH(CH3)2;Butane,1-bromo-3-methyl-;isobutylmethylbromide
    3. CAS NO:107-82-4
    4. Molecular Formula: C5H11Br
    5. Molecular Weight: 151.04
    6. EINECS: 203-522-9
    7. Product Categories: ALKYL BROMIDE
    8. Mol File: 107-82-4.mol
  • Chemical Properties

    1. Melting Point: -112 °C
    2. Boiling Point: 120-121 °C(lit.)
    3. Flash Point: 90 °F
    4. Appearance: Clear colorless/Liquid
    5. Density: 1.261 g/mL at 25 °C(lit.)
    6. Vapor Pressure: 20mmHg at 25°C
    7. Refractive Index: n20/D 1.4409(lit.)
    8. Storage Temp.: Refrigerator (+4°C) + Flammables area
    9. Solubility: H2O: slightly soluble at 16.5°C (0.02g/100ml)
    10. Water Solubility: 0.2 g/L (16 ºC)
    11. Merck: 14,5114
    12. BRN: 773652
    13. CAS DataBase Reference: 1-Bromo-3-methylbutane(CAS DataBase Reference)
    14. NIST Chemistry Reference: 1-Bromo-3-methylbutane(107-82-4)
    15. EPA Substance Registry System: 1-Bromo-3-methylbutane(107-82-4)
  • Safety Data

    1. Hazard Codes: Xn,N,Xi
    2. Statements: 10-22-37/38-52/53-51/53-36/37/38
    3. Safety Statements: 61-37/39-26-16
    4. RIDADR: UN 2341 3/PG 3
    5. WGK Germany: 3
    6. RTECS: EJ6230000
    7. TSCA: Yes
    8. HazardClass: 3
    9. PackingGroup: III
    10. Hazardous Substances Data: 107-82-4(Hazardous Substances Data)

107-82-4 Usage

Uses

1. Used in Organic Synthesis:
1-Bromo-3-methylbutane is used as an alkyl halide and organic synthesis reagent for various chemical reactions and the formation of new compounds.
2. Used in Pharmaceutical Industry:
1-Bromo-3-methylbutane is used as a reagent in the synthesis of pharmaceutical compounds, contributing to the development of new drugs and medications.
3. Used in Chemical Research:
In the field of chemical research, 1-Bromo-3-methylbutane is employed for studying its properties and potential applications in various chemical processes.
4. Used in Synthesis of 1-(3-methylbutyl)pyrrole:
1-Bromo-3-methylbutane is utilized in the synthesis of 1-(3-methylbutyl)pyrrole, which is an important compound in the chemical industry.
5. Used in Production of Pentyl Peroxy Radical:
1-Bromo-3-methylbutane is used in the production of pentyl peroxy radical through direct photolysis, which has applications in various chemical processes.
6. Used in Environmental Analysis:
1-Bromo-3-methylbutane serves as an extraction solvent for the determination of polycyclic aromatic hydrocarbons in water samples using liquid-liquid microextraction combined with gas chromatography-mass spectrometry, aiding in environmental monitoring and protection.
7. Used in the Chemical Industry:
In the chemical industry, 1-Bromo-3-methylbutane is used as an intermediate for the production of various chemicals and compounds, contributing to the development of new products and materials.

Synthesis Reference(s)

Journal of the American Chemical Society, 96, p. 8115, 1974 DOI: 10.1021/ja00833a048Organic Syntheses, Coll. Vol. 1, p. 25, 1941

Air & Water Reactions

Highly flammable. Slightly soluble in water and denser than water.

Reactivity Profile

Halogenated aliphatic compounds, such as 1-Bromo-3-methylbutane, are moderately or very reactive. Reactivity generally decreases with increased degree of substitution of halogen for hydrogen atoms. Low molecular weight haloalkanes are highly flammable and can react with some metals to form dangerous products. Materials in this group are incompatible with strong oxidizing and reducing agents. Also, they are incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides. Gives toxic fumes of bromine when burned.

Health Hazard

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

Fire Hazard

HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapor explosion hazard indoors, outdoors or in sewers. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids are lighter than water.

Safety Profile

Moderately toxic by intraperitoneal route. Flammable liquid. Dangerous fire hazard when exposed to heat or flame. When heated to decomposition it emits toxic fumes of Br-. See also BROMIDES.

Purification Methods

Shake the bromide with conc H2SO4, wash with water, dry with K2CO3 and fractionally distil it. [Beilstein 1 IV 378.]

Check Digit Verification of cas no

The CAS Registry Mumber 107-82-4 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 1,0 and 7 respectively; the second part has 2 digits, 8 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 107-82:
(5*1)+(4*0)+(3*7)+(2*8)+(1*2)=44
44 % 10 = 4
So 107-82-4 is a valid CAS Registry Number.
InChI:InChI=1/C5H11Br/c1-5(2)3-4-6/h5H,3-4H2,1-2H3

107-82-4 Well-known Company Product Price

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  • Aldrich

  • (124095)  1-Bromo-3-methylbutane  96%

  • 107-82-4

  • 124095-5G

  • 298.35CNY

  • Detail
  • Aldrich

  • (124095)  1-Bromo-3-methylbutane  96%

  • 107-82-4

  • 124095-100G

  • 305.37CNY

  • Detail
  • Aldrich

  • (124095)  1-Bromo-3-methylbutane  96%

  • 107-82-4

  • 124095-500G

  • 992.16CNY

  • Detail

107-82-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 10, 2017

Revision Date: Aug 10, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-Bromo-3-methylbutane

1.2 Other means of identification

Product number -
Other names 3-Methylbutylbromid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:107-82-4 SDS

107-82-4Related news

Vibrational analysis of alkyl bromides: Part III. Branched-chain bromides: 1-Bromo-3-methylbutane (cas 107-82-4) and 1-bromo-4-methylpentane08/18/2019

Liquid-state IR and Raman spectra and solid-state IR spectra were obtained for 1-bromo-3-methylbutane and 1-bromo-4-methylpentane. The butane exists as a mixture of PC and PH conformers in the liquid and amorphous solid, but only the PH conformer is present in the crystalline solid. The pentane ...detailed

107-82-4Relevant articles and documents

Influence of substructures on the spreading ability and hydrolysis resistance of double-tail trisiloxane surfactants

Peng, Zhongli,Lu, Caifeng,Xu, Minling

, p. 75 - 81 (2010)

Four types of novel double-tail trisiloxane surfactants of the general formula Me3SiOSiMeR1 OSiMe3 (R1 = -(CH2)3NR2 CH2CH(OH)CH 2(OCH2CH2)xOCH3; R 2 = -CH2CH(OH)CH2OCH2 (CH 2)yCH3, -CH2 (CH2) 3CH3, -CH2CH2CH(CH3) 2; x = 8.4, 12.9, 17.5, 22; y = 2, 6), have been synthesized. Their structures were characterized by proton and carbon nuclear magnetic resonance. Most of them are able to reduce the surface tension of water to less than 24 mN/m at concentration levels of 10-5 mol/L and 10-4 mol/L. The emphasis was on the influence of substructures on their spreading ability and hydrolysis resistance. The results showed that a weaker hydrophilicity of a surfactant molecule, a larger molar ratio of methyl to methylene in the whole hydrophobic groups, more flexible hydrophobic groups and introduction of a methyl group in the spacer can all improve the spreading ability of the double-tail trisiloxane surfactant solutions on low-energy solid surfaces. The double-tail trisiloxane surfactants 1F and 2F are stable for more than 270 days in a neutral environment (pH 7.0). The hydrolysis resistance of the double-tail trisiloxane surfactants can be improved by a weaker hydrophilicity of the surfactant molecule, and a larger volume of the hydrophobic groups. Copyright

Heterocyclic substituted 2-methyl-benzimidazole antiviral agents

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, (2008/06/13)

The present invention concerns antiviral compounds, their methods of preparation and their compositions, and use in the treatment of viral infections. More particularly, the invention provides heterocyclic substituted 2-methylbenzimidazole derivatives for the treatment of respiratory syncytial virus infection.

Esterification of carboxylic acid salts

-

, (2008/06/13)

Mono- or polycarboxylic acid esters are prepared by reacting a salt of such carboxylic acid with an organic halocompound, e.g., a (cyclo)alkyl, (cyclo)alkenyl, aryl or aralkyl halide, in an aqueous reaction medium, in the presence of a catalytically effective amount of a phase transfer catalyst, for example an onium salt.

Hydroxamic acids and esters

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, (2008/06/13)

The synthesis of amido substituted naphthalenes and their intermediates is described. The intermediates and amido substituted naphthalenes are useful as anti-inflammatory agents.

Silylaminyl Radicals. Part 2. Free Radical Chain Halogenation of Hydrocarbons using N-Halogenobis(trialkylsilyl)amines

Cook, Malcolm D.,Roberts, Brian P.,Singh, Karamjit

, p. 635 - 644 (2007/10/02)

The liquid-phase halogenation of a number of hydrocarbons and of 1-chlorobutane by N-halogenobis(trialkylsilyl)amines has been studied using product analysis techniques.The reactions take place by free radical chain mechanisms which involve the propagation steps generalised in equations (A) and (B) (X=Br or Cl).At 353 K, the molar reactivities of toluene (benzylic C-H) and cyclohexane towards (R3Si)2N+RH(R3Si)2NH+R (A) R+(R3Si)2NXRX+(R3Si)2N (B) (Me3Si)2N are approximately equal and toluene is 5.2 times more reactive than perdeuteriotoluene.The relative rates of hydrogen abstraction by (Me3Si)2N and (ButMe2Si)2N from the primary, secondary, and tertiary C-H groups in 2-methylbutane show that the silylaminyl radicals are not only highly reactive but also sterically demanding.Thus, at 333 K the average primary C-H reactivity is 0.6 times that of the tertiary C-H towards attack by (Me3Si)2N, but 4.2 times that of the tertiary C-H towards attack by the more bulky (ButMe2Si)2N.Silylaminyl radicals are much more reactive in hydrogen abstraction than are analogous dialkylaminyl radicals and this difference is interpreted in terms of thermodynamic and polar effects which arise because of the ?-donor-?-acceptor nature of the trialkylsilyl substituent.

3,11-Dihydro- 6H-pyrazolo[1,5-a]pyrazolo[4',3':5,6]pyrido[4,3-d]pyrimidin-6-one and derivatives thereof

-

, (2008/06/13)

New 3,11-dihydro-6H-pyrazolo[1,5-a]pyrazolo[4',3':5,6]-pyrido[4,3-d]pyrimidin-6-one and new derivatives thereof have the general formula STR1 The compounds are useful as anti-inflammatory agents.

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