Cas no 586-61-8 (1-Bromo-4-isopropylbenzene)

1-Bromo-4-isopropylbenzene structure
1-Bromo-4-isopropylbenzene structure
Product Name:1-Bromo-4-isopropylbenzene
CAS No:586-61-8
MF:C9H11Br
MW:199.087641954422
MDL:MFCD00039159
CID:38531
PubChem ID:24846325
Update Time:2025-11-02

1-Bromo-4-isopropylbenzene Chemical and Physical Properties

Names and Identifiers

    • 1-Bromo-4-isopropylbenzene
    • 4-Bromocumene~4-Isopropylbromobenzene
    • 4-Bromocumene
    • 1-bromo-4-propan-2-ylbenzene
    • 4-Bromoisopropyl Benzene
    • 4-Isopropylbromobenzene
    • Cumene, p-bromo-
    • 2-(4-Bromophenyl)propane
    • 1-bromo-4-(1-methylethyl)benzene
    • DS-14382
    • AM20060254
    • FT-0617895
    • O10388
    • CS-W019945
    • NS00033988
    • AKOS005206983
    • 4-isopropyl-1-bromobenzene
    • UNII-3SYA3DG4GJ
    • 1-bromanyl-4-propan-2-yl-benzene
    • NSC-97223
    • 1-bromo-4-(propan-2-yl)benzene
    • DTXSID7060411
    • 1-Bromo-4-isopropylbenzene, >=95.0%
    • 4-bromo-isopropylbenzene
    • p-Bromcumol
    • 4-Bromoisopropylbenzene
    • 1-bromo-4-isopropyl-benzene
    • EINECS 209-577-5
    • 4-(1-methylethyl)bromobenzene
    • A831969
    • Z732229746
    • MFCD00039159
    • 2-(p-Bromophenyl)propane
    • NSC97223
    • NSC 97223
    • p-Bromocumene
    • EN300-65439
    • Benzene, 1-bromo-4-(1-methylethyl)-
    • AC-18303
    • 586-61-8
    • p-Bromoisopropylbenzene
    • B2045
    • 4-iso-propylbromobenzene
    • SY002711
    • SCHEMBL254340
    • 1-bromo4-isopropyl-benzene
    • 3SYA3DG4GJ
    • W-105371
    • 4-Bromoisopropylbenzene,97%
    • Cumene, pbromo
    • pBromocumene
    • DB-019084
    • 2(4Bromophenyl)propane
    • DTXCID2042438
    • Cumene, pbromo (8CI)
    • 4Bromocumene
    • pBromoisopropylbenzene
    • Benzene, 1bromo4(1methylethyl)
    • 2(pBromophenyl)propane
    • 1-ISOPROPYL-4-BROMOBENZENE
    • 4Isopropylbromobenzene
    • MDL: MFCD00039159
    • Inchi: 1S/C9H11Br/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,1-2H3
    • InChI Key: MOZHUOIQYVYEPN-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=CC=1)C(C)C
    • BRN: 1858096

Computed Properties

  • Exact Mass: 198.00400
  • Monoisotopic Mass: 198.004
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 90.9
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 0A^2

Experimental Properties

  • Color/Form: No data available
  • Density: 1.286
  • Melting Point: -22°C(lit.)
  • Boiling Point: 219°C(lit.)
  • Flash Point: 94 oC
  • Refractive Index: 1.537
  • Water Partition Coefficient: Insoluble in water
  • PSA: 0.00000
  • LogP: 3.57250

1-Bromo-4-isopropylbenzene Security Information

  • Symbol: GHS07 GHS09
  • Signal Word:Warning
  • Hazard Statement: H302,H411
  • Warning Statement: P273
  • Hazardous Material transportation number:UN 2810 6.1/PG 3
  • WGK Germany:2
  • Hazard Category Code: R22;R51/53
  • Safety Instruction: S60
  • Hazardous Material Identification: Xn N
  • HazardClass:IRRITANT
  • TSCA:Yes
  • Risk Phrases:R22; R51/53
  • Safety Term:S60
  • Storage Condition:Store at 4°C,-4At ℃Store…Better

1-Bromo-4-isopropylbenzene Customs Data

  • HS CODE:2903999090
  • Customs Data:

    China Customs Code:

    2903999090

    Overview:

    2903999090 Other aromatic halogenated derivatives. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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1-Bromo-4-isopropylbenzene Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
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(CAS:586-61-8)4-溴異丙苯
Order Number:LE2471920
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:40
Price ($):discuss personally
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:586-61-8)1-Bromo-4-isopropylbenzene
Order Number:A942780
Stock Status:in Stock
Quantity:100g/500g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 15:44
Price ($):188.0/882.0

Additional information on 1-Bromo-4-isopropylbenzene

Recent Advances in the Application of 1-Bromo-4-isopropylbenzene (CAS: 586-61-8) in Chemical and Biomedical Research

1-Bromo-4-isopropylbenzene (CAS: 586-61-8) is an important intermediate in organic synthesis, particularly in the pharmaceutical and agrochemical industries. Recent studies have highlighted its versatile applications in the synthesis of complex molecules, drug discovery, and material science. This research brief aims to summarize the latest findings related to this compound, focusing on its chemical properties, synthetic utility, and emerging biomedical applications.

In the field of organic synthesis, 1-Bromo-4-isopropylbenzene has been widely used as a building block for the preparation of more complex aromatic compounds. A recent study published in the Journal of Organic Chemistry demonstrated its effectiveness in Suzuki-Miyaura cross-coupling reactions, enabling the synthesis of biaryl derivatives with high yields and excellent selectivity. The electron-donating isopropyl group was found to significantly influence the reactivity of the bromo substituent, making it a valuable tool for constructing diverse molecular architectures.

From a biomedical perspective, researchers have explored the potential of 1-Bromo-4-isopropylbenzene derivatives as bioactive molecules. A 2023 study in Bioorganic & Medicinal Chemistry reported the development of novel antimicrobial agents based on this scaffold. The compounds showed promising activity against drug-resistant bacterial strains, with minimal cytotoxicity to human cells. Molecular docking studies suggested that the isopropyl group plays a crucial role in enhancing binding affinity to target proteins.

In material science, 1-Bromo-4-isopropylbenzene has been utilized as a precursor for the synthesis of liquid crystalline materials. A team at MIT recently published work demonstrating how derivatives of this compound can form stable mesophases with unique optical properties. These materials show potential for applications in display technologies and organic electronics, offering advantages in terms of thermal stability and processability.

The safety profile and environmental impact of 1-Bromo-4-isopropylbenzene have also been subjects of recent investigation. Regulatory agencies have updated their guidelines regarding the handling and disposal of this compound, reflecting new data on its biodegradation pathways and ecotoxicological effects. These developments are particularly relevant for industrial-scale applications where environmental considerations are paramount.

Looking forward, the versatility of 1-Bromo-4-isopropylbenzene continues to inspire innovative research across multiple disciplines. Current projects are exploring its use in metal-organic frameworks (MOFs), as a ligand in catalytic systems, and as a core structure for developing new classes of pharmaceutical agents. The compound's unique combination of reactivity and stability makes it particularly valuable for these cutting-edge applications.

In conclusion, 1-Bromo-4-isopropylbenzene (CAS: 586-61-8) remains a compound of significant interest in chemical and biomedical research. Recent advances have expanded our understanding of its properties and potential applications, while also addressing important safety and environmental considerations. As synthetic methodologies continue to evolve, we can anticipate even more innovative uses for this versatile building block in the coming years.

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:586-61-8)4-溴異丙苯
LE2471920
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email
Amadis Chemical Company Limited
(CAS:586-61-8)1-Bromo-4-isopropylbenzene
A942780
Purity:99%/99%
Quantity:100g/500g
Price ($):188.0/882.0
Email