Cas no 331274-67-0 (1-Bromo-3-(4-methylpiperazinocarbonyl)benzene)
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene Chemical and Physical Properties
Names and Identifiers
-
- (3-bromophenyl)-(4-methylpiperazin-1-yl)methanone
- (3-BROMOPHENYL)(4-METHYLPIPERAZIN-1-YL)METHANONE
- 1-Bromo-3-(4-methylpiperazinocarbonyl)benzene
- AC1LFIBV
- AC1Q3ZSH
- ACMC-209hym
- CBDivE_014203
- Oprea1_764450
- SureCN1688347
- AKOS000178614
- DTXSID90353810
- 331274-67-0
- 1-(3-Bromophenyl)carbonyl-4-methylpiperazine
- AB00079109-01
- 1-(3-bromobenzoyl)-4-methylpiperazine
- N10345
- MFCD00594888
- SCHEMBL1688347
- BS-17018
- DB-362033
- STK408101
- CS-0151087
-
- MDL: MFCD00594888
- Inchi: 1S/C12H15BrN2O/c1-14-5-7-15(8-6-14)12(16)10-3-2-4-11(13)9-10/h2-4,9H,5-8H2,1H3
- InChI Key: UWDFKAKQJOXLHT-UHFFFAOYSA-N
- SMILES: BrC1=CC=CC(=C1)C(N1CCN(C)CC1)=O
Computed Properties
- Exact Mass: 282.03700
- Monoisotopic Mass: 282.03678g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 251
- 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: 1
- Topological Polar Surface Area: 23.6?2
Experimental Properties
- PSA: 23.55000
- LogP: 1.71250
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene Customs Data
- HS CODE:2933599090
- Customs Data:
China Customs Code:
2933599090Overview:
2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A139002955-5g |
(3-Bromophenyl)(4-methylpiperazin-1-yl)methanone |
331274-67-0 | 95% | 5g |
$166.40 | 2023-09-02 | |
| TRC | B697513-100mg |
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene |
331274-67-0 | 100mg |
$ 64.00 | 2023-04-18 | ||
| TRC | B697513-250mg |
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene |
331274-67-0 | 250mg |
$ 75.00 | 2023-04-18 | ||
| TRC | B697513-500mg |
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene |
331274-67-0 | 500mg |
$ 87.00 | 2023-04-18 | ||
| TRC | B697513-1g |
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene |
331274-67-0 | 1g |
$ 98.00 | 2023-04-18 | ||
| Chemenu | CM169206-25g |
(3-Bromophenyl)(4-methylpiperazin-1-yl)methanone |
331274-67-0 | 95% | 25g |
$427 | 2021-08-05 | |
| Chemenu | CM169206-1g |
(3-Bromophenyl)(4-methylpiperazin-1-yl)methanone |
331274-67-0 | 95% | 1g |
$*** | 2023-05-30 | |
| Chemenu | CM169206-5g |
(3-Bromophenyl)(4-methylpiperazin-1-yl)methanone |
331274-67-0 | 95% | 5g |
$*** | 2023-05-30 | |
| Chemenu | CM169206-25g |
(3-Bromophenyl)(4-methylpiperazin-1-yl)methanone |
331274-67-0 | 95% | 25g |
$*** | 2023-05-30 | |
| abcr | AB309723-1 g |
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene; 98% |
331274-67-0 | 1g |
€127.00 | 2023-04-26 |
1-Bromo-3-(4-methylpiperazinocarbonyl)benzene Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
Additional information on 1-Bromo-3-(4-methylpiperazinocarbonyl)benzene
1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene
The compound 1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene (CAS No: 331274-67-0) is a significant organic molecule with a unique structure and diverse applications in the field of chemistry and materials science. This compound is characterized by its bromine atom attached to a benzene ring, which is further substituted with a 4-methylpiperazinocarbonyl group at the 3-position. The presence of these functional groups imparts the molecule with distinctive chemical properties, making it a valuable compound in various research and industrial settings.
Recent advancements in synthetic chemistry have enabled the efficient synthesis of 1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene through various methodologies, including nucleophilic aromatic substitution and coupling reactions. These methods have not only improved the yield but also enhanced the purity of the compound, making it more accessible for large-scale production and application.
The structural features of 1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene make it an ideal candidate for exploring its potential in drug discovery and development. The bromine atom serves as an excellent leaving group, facilitating further substitution reactions to introduce bioactive moieties. Additionally, the piperazine ring, a six-membered heterocyclic structure, contributes to the molecule's ability to interact with biological targets, such as enzymes and receptors, through hydrogen bonding and hydrophobic interactions.
Recent studies have highlighted the role of 1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene in medicinal chemistry as a precursor for designing bioactive compounds with potential therapeutic applications. For instance, researchers have utilized this compound as a building block for synthesizing inhibitors of kinase enzymes, which are implicated in various diseases, including cancer and inflammatory disorders.
In addition to its role in drug discovery, 1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene has found applications in materials science, particularly in the synthesis of advanced materials such as polymers and hybrid organic-inorganic frameworks. The bromine atom's reactivity allows for easy incorporation into polymer backbones, while the piperazine group provides additional functionality for cross-linking and network formation.
From an environmental perspective, understanding the degradation pathways and toxicity profiles of 1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene is crucial for ensuring its safe use in industrial processes. Recent research has focused on evaluating its biodegradation under various conditions, with findings suggesting that it undergoes microbial degradation under aerobic conditions, reducing its environmental impact.
In conclusion, 1-Bromo-3-(4-Methylpiperazinocarbonyl)Benzene (CAS No: 331274-67-0) stands out as a versatile compound with wide-ranging applications across multiple disciplines. Its unique structure and reactivity continue to drive innovative research efforts, paving the way for new discoveries and advancements in chemistry and related fields.
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