538-93-2,MFCD00008936
Catalog No.:AA003R0B

538-93-2 | Isobutylbenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$27.00   $19.00
- +
25g
98%
in stock  
$43.00   $30.00
- +
100g
98%
in stock  
$107.00   $75.00
- +
500g
98%
in stock  
$393.00 $275.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003R0B
Chemical Name:
Isobutylbenzene
CAS Number:
538-93-2
Molecular Formula:
C10H14
Molecular Weight:
134.2182
MDL Number:
MFCD00008936
SMILES:
CC(Cc1ccccc1)C
NSC Number:
24848
UN Number:
2709
Properties
Properties
 
BP:
170 °C736 mm Hg(lit.)  
Form:
Solid  
MP:
−51 °C(lit.)  
Refractive Index:
n20/D 1.486(lit.)  
Solubility:
0.01g/l  
Storage:
Room Temperature;Inert atmosphere;  

Computed Properties
 
Complexity:
78  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.9  

Literature

Title: β-Caryophyllene, a Compound Isolated from the Biblical Balm of Gilead (Commiphora gileadensis), Is a Selective Apoptosis Inducer for Tumor Cell Lines.

Journal: Evidence-based complementary and alternative medicine : eCAM 20120101

Title: Induction of isoprenyl diphosphate synthases, plant hormones and defense signalling genes correlates with traumatic resin duct formation in Norway spruce (Picea abies).

Journal: Plant molecular biology 20111201

Title: Measurement of the Soret and diffusion coefficients for benchmark binary mixtures by means of digital interferometry.

Journal: The Journal of chemical physics 20110128

Title: Subgroup 4 R2R3-MYBs in conifer trees: gene family expansion and contribution to the isoprenoid- and flavonoid-oriented responses.

Journal: Journal of experimental botany 20100901

Title: Two conformers observed and characterized in isobutylbenzene.

Journal: The journal of physical chemistry. A 20100121

Title: Laser microdissection of conifer stem tissues: isolation and analysis of high quality RNA, terpene synthase enzyme activity and terpenoid metabolites from resin ducts and cambial zone tissue of white spruce (Picea glauca).

Journal: BMC plant biology 20100101

Title: Thermostable lipases from the extreme thermophilic anaerobic bacteria Thermoanaerobacter thermohydrosulfuricus SOL1 and Caldanaerobacter subterraneus subsp. tengcongensis.

Journal: Extremophiles : life under extreme conditions 20090901

Title: 4-[(4-Fluoro-benzyl-idene)amino]-3-[1-(4-isobutyl-phen-yl)eth-yl]-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online 20090901

Title: N'-[(E)-4-Bromo-benzyl-idene]-2-(4-isobutyl-phen-yl)propanohydrazide.

Journal: Acta crystallographica. Section E, Structure reports online 20090601

Title: N'-[(E)-4-Chloro-benzyl-idene]-2-(4-isobutyl-phen-yl)propanohydrazide.

Journal: Acta crystallographica. Section E, Structure reports online 20090601

Title: 4-[(E)-4-Bromo-benzyl-ideneamino]-3-[1-(4-isobutyl-phen-yl)eth-yl]-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online 20090601

Title: 4-[(E)-4-Methoxy-benzyl-ideneamino]-3-{1-[4-(2-methyl-prop-yl)phen-yl]eth-yl}-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online 20090501

Title: 4-(4-Bromo-benzyl-ideneamino)-3-{1-[4-(2-methyl-prop-yl)phen-yl]eth-yl}-1-(mor-phol-ino-meth-yl)-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online 20080801

Title: 3-[1-(4-Isobutyl-phen-yl)eth-yl]-6-(4-methyl-phen-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia-diazole.

Journal: Acta crystallographica. Section E, Structure reports online 20080601

Title: Does egg deposition by herbivorous pine sawflies affect transcription of sesquiterpene synthases in pine?

Journal: Planta 20080101

Title: Thermal diffusion forced Rayleigh scattering setup optimized for aqueous mixtures.

Journal: The journal of physical chemistry. B 20071227

Title: Optical cell with periodic resistive heating for the measurement of heat, mass, and thermal diffusions in liquid mixtures.

Journal: The Review of scientific instruments 20070801

Title: The molecular and electronic structure of the electron transfer series [Fe2(NO)2(S2C2R2)3](z) (z = 0, -1, -2; R = phenyl, p-tolyl, p-tert-butylphenyl).

Journal: Inorganic chemistry 20070402

Title: Influence of isotopic substitution on the diffusion and thermal diffusion coefficient of binary liquids.

Journal: The European physical journal. E, Soft matter 20061201

Title: Water solubilization capacity of mixed reverse micelles: effect of surfactant component, the nature of the oil, and electrolyte concentration.

Journal: Journal of colloid and interface science 20050801

Title: Universal isotope effect in thermal diffusion of mixtures containing cyclohexane and cyclohexane-d12.

Journal: The Journal of chemical physics 20050701

Title: Decoys for docking.

Journal: Journal of medicinal chemistry 20050602

Title: Relative ototoxicity of 21 aromatic solvents.

Journal: Archives of toxicology 20050601

Title: Intramolecular electrophilic aromatic substitution in gas-phase-protonated difunctional compounds containing one or two arylmethyl groups.

Journal: Journal of mass spectrometry : JMS 20031101

Title: Synthesis and calcium channel antagonist activity of new 1,4-dihydropyridine derivatives containing dichloroimidazolyl substituents.

Journal: Arzneimittel-Forschung 20020101

Title: The enantioselective immunoaffinity extraction of an optically active ibuprofen-modified peptide fragment.

Journal: Analytical biochemistry 20010901

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SDS
Tags:538-93-2 Molecular Formula|538-93-2 MDL|538-93-2 SMILES|538-93-2 Isobutylbenzene
Catalog No.: AA003R0B
538-93-2,MFCD00008936
538-93-2 | Isobutylbenzene
Pack Size: 5g
Purity: 98%
in stock
$27.00 $19.00
Pack Size: 25g
Purity: 98%
in stock
$43.00 $30.00
Pack Size: 100g
Purity: 98%
in stock
$107.00 $75.00
Pack Size: 500g
Purity: 98%
in stock
$393.00 $275.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003R0B
Chemical Name: Isobutylbenzene
CAS Number: 538-93-2
Molecular Formula: C10H14
Molecular Weight: 134.2182
MDL Number: MFCD00008936
SMILES: CC(Cc1ccccc1)C
NSC Number: 24848
UN Number: 2709
Properties
BP: 170 °C736 mm Hg(lit.)  
Form: Solid  
MP: −51 °C(lit.)  
Refractive Index: n20/D 1.486(lit.)  
Solubility: 0.01g/l  
Storage: Room Temperature;Inert atmosphere;  
Complexity: 78  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 0  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.9  
Literature fold

Title: β-Caryophyllene, a Compound Isolated from the Biblical Balm of Gilead (Commiphora gileadensis), Is a Selective Apoptosis Inducer for Tumor Cell Lines.

Journal: Evidence-based complementary and alternative medicine : eCAM20120101

Title: Induction of isoprenyl diphosphate synthases, plant hormones and defense signalling genes correlates with traumatic resin duct formation in Norway spruce (Picea abies).

Journal: Plant molecular biology20111201

Title: Measurement of the Soret and diffusion coefficients for benchmark binary mixtures by means of digital interferometry.

Journal: The Journal of chemical physics20110128

Title: Subgroup 4 R2R3-MYBs in conifer trees: gene family expansion and contribution to the isoprenoid- and flavonoid-oriented responses.

Journal: Journal of experimental botany20100901

Title: Two conformers observed and characterized in isobutylbenzene.

Journal: The journal of physical chemistry. A20100121

Title: Laser microdissection of conifer stem tissues: isolation and analysis of high quality RNA, terpene synthase enzyme activity and terpenoid metabolites from resin ducts and cambial zone tissue of white spruce (Picea glauca).

Journal: BMC plant biology20100101

Title: Thermostable lipases from the extreme thermophilic anaerobic bacteria Thermoanaerobacter thermohydrosulfuricus SOL1 and Caldanaerobacter subterraneus subsp. tengcongensis.

Journal: Extremophiles : life under extreme conditions20090901

Title: 4-[(4-Fluoro-benzyl-idene)amino]-3-[1-(4-isobutyl-phen-yl)eth-yl]-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online20090901

Title: N'-[(E)-4-Bromo-benzyl-idene]-2-(4-isobutyl-phen-yl)propanohydrazide.

Journal: Acta crystallographica. Section E, Structure reports online20090601

Title: N'-[(E)-4-Chloro-benzyl-idene]-2-(4-isobutyl-phen-yl)propanohydrazide.

Journal: Acta crystallographica. Section E, Structure reports online20090601

Title: 4-[(E)-4-Bromo-benzyl-ideneamino]-3-[1-(4-isobutyl-phen-yl)eth-yl]-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online20090601

Title: 4-[(E)-4-Methoxy-benzyl-ideneamino]-3-{1-[4-(2-methyl-prop-yl)phen-yl]eth-yl}-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online20090501

Title: 4-(4-Bromo-benzyl-ideneamino)-3-{1-[4-(2-methyl-prop-yl)phen-yl]eth-yl}-1-(mor-phol-ino-meth-yl)-1H-1,2,4-triazole-5(4H)-thione.

Journal: Acta crystallographica. Section E, Structure reports online20080801

Title: 3-[1-(4-Isobutyl-phen-yl)eth-yl]-6-(4-methyl-phen-yl)-1,2,4-triazolo[3,4-b][1,3,4]thia-diazole.

Journal: Acta crystallographica. Section E, Structure reports online20080601

Title: Does egg deposition by herbivorous pine sawflies affect transcription of sesquiterpene synthases in pine?

Journal: Planta20080101

Title: Thermal diffusion forced Rayleigh scattering setup optimized for aqueous mixtures.

Journal: The journal of physical chemistry. B20071227

Title: Optical cell with periodic resistive heating for the measurement of heat, mass, and thermal diffusions in liquid mixtures.

Journal: The Review of scientific instruments20070801

Title: The molecular and electronic structure of the electron transfer series [Fe2(NO)2(S2C2R2)3](z) (z = 0, -1, -2; R = phenyl, p-tolyl, p-tert-butylphenyl).

Journal: Inorganic chemistry20070402

Title: Influence of isotopic substitution on the diffusion and thermal diffusion coefficient of binary liquids.

Journal: The European physical journal. E, Soft matter20061201

Title: Water solubilization capacity of mixed reverse micelles: effect of surfactant component, the nature of the oil, and electrolyte concentration.

Journal: Journal of colloid and interface science20050801

Title: Universal isotope effect in thermal diffusion of mixtures containing cyclohexane and cyclohexane-d12.

Journal: The Journal of chemical physics20050701

Title: Decoys for docking.

Journal: Journal of medicinal chemistry20050602

Title: Relative ototoxicity of 21 aromatic solvents.

Journal: Archives of toxicology20050601

Title: Intramolecular electrophilic aromatic substitution in gas-phase-protonated difunctional compounds containing one or two arylmethyl groups.

Journal: Journal of mass spectrometry : JMS20031101

Title: Synthesis and calcium channel antagonist activity of new 1,4-dihydropyridine derivatives containing dichloroimidazolyl substituents.

Journal: Arzneimittel-Forschung20020101

Title: The enantioselective immunoaffinity extraction of an optically active ibuprofen-modified peptide fragment.

Journal: Analytical biochemistry20010901

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