Cas no 1187966-48-8 (1-(Benzyloxy)-3-bromo-5-chlorobenzene)
1-(Benzyloxy)-3-bromo-5-chlorobenzene Chemical and Physical Properties
Names and Identifiers
-
- 1-(Benzyloxy)-3-bromo-5-chlorobenzene
- 1-benzyloxy-3-bromo-5-chloro-benzene
- BS-25412
- AKOS015839426
- PKROBCVIFMCNTC-UHFFFAOYSA-N
- E91218
- MFCD16660296
- 1-bromo-3-chloro-5-phenylmethoxybenzene
- DTXSID70682115
- 1187966-48-8
- DB-362954
- CS-0193279
- SCHEMBL347904
-
- MDL: MFCD16660296
- Inchi: 1S/C13H10BrClO/c14-11-6-12(15)8-13(7-11)16-9-10-4-2-1-3-5-10/h1-8H,9H2
- InChI Key: PKROBCVIFMCNTC-UHFFFAOYSA-N
- SMILES: BrC1=CC(=CC(=C1)OCC1C=CC=CC=1)Cl
Computed Properties
- Exact Mass: 295.96000
- Monoisotopic Mass: 295.96036g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 206
- 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
- XLogP3: 4.7
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- Density: 1.5±0.1 g/cm3
- Boiling Point: 362.1±27.0 °C at 760 mmHg
- Flash Point: 172.8±23.7 °C
- PSA: 9.23000
- LogP: 4.68150
- Vapor Pressure: 0.0±0.8 mmHg at 25°C
1-(Benzyloxy)-3-bromo-5-chlorobenzene Security Information
- Signal Word:warning
- Hazard Statement: H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement: P264+P280+P305+P351+P338+P337+P313
- Safety Instruction: H303+H313+H333
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
1-(Benzyloxy)-3-bromo-5-chlorobenzene Customs Data
- HS CODE:2909309090
- Customs Data:
China Customs Code:
2909309090Overview:
2909309090 Other aromatic ethers and their halogenated derivatives\sulfonation\Nitrated derivative(Including nitrosative derivatives).Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%
1-(Benzyloxy)-3-bromo-5-chlorobenzene Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A019088220-25g |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 95% | 25g |
$998.00 | 2023-09-04 | |
| TRC | B291455-100mg |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 100mg |
$ 64.00 | 2023-04-18 | ||
| TRC | B291455-250mg |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 250mg |
$ 75.00 | 2023-04-18 | ||
| TRC | B291455-500mg |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 500mg |
$ 87.00 | 2023-04-18 | ||
| TRC | B291455-1g |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 1g |
$ 98.00 | 2023-04-18 | ||
| Fluorochem | 218685-1g |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 95% | 1g |
£100.00 | 2021-06-29 | |
| Fluorochem | 218685-5g |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 95% | 5g |
£300.00 | 2021-06-29 | |
| Fluorochem | 218685-25g |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 95% | 25g |
£850.00 | 2021-06-29 | |
| A2B Chem LLC | AD59737-1g |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 98% | 1g |
$97.00 | 2024-04-20 | |
| A2B Chem LLC | AD59737-5g |
1-(Benzyloxy)-3-bromo-5-chlorobenzene |
1187966-48-8 | 98% | 5g |
$271.00 | 2024-04-20 |
1-(Benzyloxy)-3-bromo-5-chlorobenzene Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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5. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
Additional information on 1-(Benzyloxy)-3-bromo-5-chlorobenzene
1-(Benzyloxy)-3-bromo-5-chlorobenzene: A Comprehensive Overview
1-(Benzyloxy)-3-bromo-5-chlorobenzene is a complex aromatic compound with the CAS number 1187966-48-8. This compound is characterized by its unique structure, which includes a benzyloxy group attached to the benzene ring at position 1, along with bromine and chlorine substituents at positions 3 and 5, respectively. The presence of these halogen substituents and the benzyloxy group makes this compound highly versatile in various chemical reactions and applications.
The synthesis of 1-(Benzyloxy)-3-bromo-5-chlorobenzene typically involves multi-step organic synthesis processes. Recent studies have highlighted the use of electrophilic substitution reactions, where the benzene ring undergoes sequential substitution to introduce the bromine, chlorine, and benzyloxy groups. The choice of catalysts and reaction conditions plays a critical role in achieving high yields and purity. Researchers have also explored green chemistry approaches to minimize environmental impact during the synthesis process.
One of the most significant applications of 1-(Benzyloxy)-3-bromo-5-chlorobenzene is in the field of pharmaceutical chemistry. The compound serves as an intermediate in the synthesis of various bioactive molecules, including antiviral and anticancer agents. For instance, recent studies have demonstrated its potential as a precursor for developing inhibitors targeting specific protein kinases involved in cancer progression. The bromine and chlorine substituents contribute to the compound's reactivity, making it an ideal building block for medicinal chemists.
In addition to pharmaceutical applications, 1-(Benzyloxy)-3-bromo-5-chlorobenzene has found utility in agrochemicals. Its ability to undergo nucleophilic aromatic substitution reactions makes it valuable in the development of pesticides and herbicides. Recent advancements in this area have focused on enhancing the selectivity and bioavailability of derivatives derived from this compound, ensuring minimal environmental impact while maintaining efficacy.
The electronic properties of 1-(Benzyloxy)-3-bromo-5-chlorobenzene are another area of active research. Computational studies have revealed that the substituents on the benzene ring significantly influence the compound's electron distribution, which is crucial for its reactivity in various chemical transformations. These insights have been instrumental in designing more efficient synthetic routes and optimizing reaction conditions.
From an environmental perspective, understanding the fate and behavior of 1-(Benzyloxy)-3-bromo-5-chlorobenzene in natural systems is essential. Recent studies have investigated its biodegradation pathways under aerobic and anaerobic conditions, providing valuable information for risk assessment and waste management strategies. The compound's stability under various environmental conditions has also been a focus of research, particularly in relation to its potential persistence in soil and water systems.
In conclusion, 1-(Benzyloxy)-3-bromo-5-chlorobenzene is a multifaceted compound with diverse applications across multiple disciplines. Its unique structure, reactivity, and versatility make it a valuable tool in organic synthesis, pharmaceutical development, and agrochemicals. As research continues to uncover new insights into its properties and potential uses, this compound is poised to play an even greater role in advancing chemical science.
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