Cas no 629-03-8 (1,6-Dibromohexane)
1,6-Dibromohexane Chemical and Physical Properties
Names and Identifiers
-
- 1,6-Dibromohexane
- Hexamethylene dibromide
- 1,6-Dibromohexane, (Hexamethylene dibromide)
- Dibromo-1,6 hexane
- 1,6 Di Bromo Hexane
- 1,6-bis(bromo)hexane
- 1,6-dibromohexamethylene
- 1,6-Dibromohexan
- 1,6-Dibromohexan [German]
- 1,6-Dibromo-n-hexane
- Hexamethylene Bromide
- HEXANE,1,6-DIBROMO
- HEXANE, 1,6-DIBROMO-
- alpha,omega-Dibromohexane
- SGRHVVLXEBNBDV-UHFFFAOYSA-N
- 7L71Q7Y230
- 1,6-Dibromohexan [German]
- 1.6-dibromohexane
- 1,6 dibromohexane
- Hexane,6-dibromo-
- 1,6-dibromo hexane
- 1,6-di-bromohexane
- 1,6-dibromo-hexane
- 1, 6-Dibromohexa
- EN300-19705
- A24632
- NCGC00255958-01
- EINECS 211-067-2
- NS00002783
- SCHEMBL53228
- AS-13088
- InChI=1/C6H12Br2/c7-5-3-1-2-4-6-8/h1-6H
- FT-0606998
- D77996
- F0001-1698
- NSC7306
- D0185
- WLN: E6E
- UNII-7L71Q7Y230
- Tox21_302059
- AKOS009031430
- J-504033
- AI3-11008
- CHEMBL3559826
- NSC-7306
- BR1156
- 1,6-Dibromohexane, 96%
- 4-01-00-00354 (Beilstein Handbook Reference)
- BP-21392
- CAS-629-03-8
- EC 211-067-2
- Hexane, 1,6-dibromo
- AMY11215
- NSC 7306
- Br(CH2)6Br
- 629-03-8
- BRN 1236322
- 1, 6-Dibromohexane
- DTXSID4044452
- 1,6-Dibromhexan;1,6-Dibromohexan;1,6-dibromo-hexan;alpha,omega-dibromohexane;Dibromo-1,6 hexane
- MFCD00000272
- CS-0015831
- DTXCID2024452
- Q161558
- C6H12Br2
- 1,6-Dibromohexane,99%
- 1,6dibromohexane
- 1,6Dibromonhexane
- 1,6Dibromohexan
- DB-003160
- Hexane, 1,6dibromo
- Hexane, 1,6-dibromo-; 1,6-Dibromohexane; 1,6-Dibromo-n-hexane; Hexamethylene dibromide; NSC 7306; a,?-Dibromohexane
- alpha,omegaDibromohexane
- FD00939
- 211-067-2
-
- MDL: MFCD00000272
- Inchi: 1S/C6H12Br2/c7-5-3-1-2-4-6-8/h1-6H2
- InChI Key: SGRHVVLXEBNBDV-UHFFFAOYSA-N
- SMILES: BrCCCCCCBr
- BRN: 1236322
Computed Properties
- Exact Mass: 241.93100
- Monoisotopic Mass: 241.930576
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 8
- Rotatable Bond Count: 5
- Complexity: 31.5
- 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: 3.2
- Topological Polar Surface Area: 0
Experimental Properties
- Color/Form: Colorless liquid
- Density: 1.586?g/mL?at 25?°C(lit.)
- Melting Point: -2°C(lit.)
- Boiling Point: 246°C(lit.)
- Flash Point: Degrees Fahrenheit:235.4°F
Degrees Celsius:113°C - Refractive Index: n20/D 1.507(lit.)
- Water Partition Coefficient: Insoluble
- Stability/Shelf Life: Stable. Incompatible with strong oxidizing agents.
- PSA: 0.00000
- LogP: 3.33660
- FEMA: 2451
- Solubility: Soluble in ether, benzene, chloroform, ethanol. Insoluble in water.
1,6-Dibromohexane Security Information
-
Symbol:
- Prompt:warning
- Signal Word:Danger
- Hazard Statement: H300,H317
- Warning Statement: P264,P280,P301+P310
- Hazardous Material transportation number:UN 2810 6.1/PG 3
- WGK Germany:3
- Hazard Category Code: 25-43-51/53
- Safety Instruction: S36-S45-S61
- RTECS:MO1515000
-
Hazardous Material Identification:
- HazardClass:6.1
- PackingGroup:Ⅲ
- TSCA:Yes
- Storage Condition:Sealed in dry,Room Temperature
- Packing Group:III
- Hazard Level:9
- Safety Term:9
- Packing Group:III
- Risk Phrases:R25; R51/53
1,6-Dibromohexane Customs Data
- HS CODE:2903299090
- Customs Data:
China Customs Code:
2903299090Overview:
HS: 2903299090. Unsaturated chlorinated derivatives of other acyclic hydrocarbons. 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:
2903299090 other unsaturated chlorinated derivatives of acyclic hydrocarbons.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%
1,6-Dibromohexane Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | D41007-25G |
1,6-Dibromohexane |
629-03-8 | 25g |
¥197.78 | 2023-11-09 | ||
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | D41007-100G |
1,6-Dibromohexane |
629-03-8 | 100g |
¥359.96 | 2023-11-09 | ||
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | D41007-500G |
1,6-Dibromohexane |
629-03-8 | 500g |
¥953.3 | 2023-11-09 | ||
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R017494-2.5kg |
1,6-Dibromohexane |
629-03-8 | 97% | 2.5kg |
¥818 | 2024-05-22 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R017494-100g |
1,6-Dibromohexane |
629-03-8 | 97% | 100g |
¥60 | 2024-05-22 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R017494-500g |
1,6-Dibromohexane |
629-03-8 | 97% | 500g |
¥207 | 2024-05-22 | |
| TRC | D425585-100g |
1,6-Dibromohexane |
629-03-8 | 100g |
$ 150.00 | 2023-09-07 | ||
| TRC | D425585-250g |
1,6-Dibromohexane |
629-03-8 | 250g |
$ 242.00 | 2023-09-07 | ||
| TRC | D425585-1000g |
1,6-Dibromohexane |
629-03-8 | 1000g |
$ 690.00 | 2022-06-05 | ||
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | D106541-100g |
1,6-Dibromohexane |
629-03-8 | 97% | 100g |
¥39.90 | 2023-09-03 |
1,6-Dibromohexane Suppliers
1,6-Dibromohexane Related Literature
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Xuzhao Yang,Hao Song,Jun Wang,Wenyuan Zou RSC Adv. 2016 6 29172
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2. Characterization of gauche end-groups in α,ω-dibromoalkanes: vibrational properties of the 1,6-dibromohexane/urea inclusion compoundLaurent Elizabe,Abdelkrim El Baghdadi,Sharon P. Smart,Fran?ois Guillaume,Kenneth D. M. Harris J. Chem. Soc. Faraday Trans. 1996 92 267
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Hai-Son Dang,Patric Jannasch J. Mater. Chem. A 2016 4 17138
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Xiaotong Fan,Ruizhen Tian,Tingting Wang,Shengda Liu,Liang Wang,Jiayun Xu,Junqiu Liu,Min Ma,Zhengzhi Wu Nanoscale 2018 10 22155
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Wenjin Cheng,Hao Tang,Rongrong Wang,Lingyun Wang,Herbert Meier,Derong Cao Chem. Commun. 2016 52 8075
Additional information on 1,6-Dibromohexane
Chemical Profile of 1,6-Dibromohexane (CAS No: 629-03-8)
1,6-Dibromohexane, with the chemical formula C?H??Br?, is a brominated alkane that has garnered significant attention in the field of organic synthesis and material science. This compound, identified by its unique CAS number 629-03-8, serves as a versatile intermediate in the preparation of various functionalized molecules. Its molecular structure, featuring two bromine atoms attached to a hexane chain, makes it a valuable precursor for further chemical modifications, including cross-coupling reactions, polymerization processes, and the synthesis of pharmaceutical intermediates.
The utility of 1,6-Dibromohexane stems from its reactivity at the bromine substituents. These atoms can participate in nucleophilic substitution reactions, allowing chemists to introduce diverse functional groups into the molecule. Such transformations are pivotal in medicinal chemistry, where tailored molecular architectures are essential for achieving desired pharmacological properties. Recent advancements in synthetic methodologies have highlighted the role of 1,6-Dibromohexane in constructing complex scaffolds that mimic natural products and bioactive compounds.
In the realm of polymer science, 1,6-Dibromohexane has been explored as a monomer or crosslinking agent in the development of novel polymers. Its ability to form covalent bonds with other reactive species enables the creation of materials with tailored mechanical and thermal properties. For instance, researchers have utilized this compound to synthesize block copolymers that exhibit stimuli-responsive behaviors, which are relevant for applications in smart materials and drug delivery systems.
Recent studies have also demonstrated the potential of 1,6-Dibromohexane in catalytic processes. The bromine atoms can act as anchors for transition metal catalysts, facilitating various organic transformations such as Heck coupling and Suzuki-Miyaura reactions. These reactions are cornerstone techniques in modern synthetic chemistry, enabling the efficient construction of carbon-carbon bonds. The incorporation of 1,6-Dibromohexane into these protocols has streamlined synthetic routes for complex molecules, including those with pharmaceutical relevance.
The pharmaceutical industry has shown particular interest in derivatives of 1,6-Dibromohexane due to their structural versatility. Researchers have employed this compound as a building block in the synthesis of kinase inhibitors, which are critical targets for treating various cancers and inflammatory diseases. By modifying the positions and types of substituents on the hexane backbone, scientists can fine-tune the binding affinity and selectivity of these inhibitors towards their biological targets. Such efforts align with ongoing trends in drug discovery aimed at developing more effective and personalized therapies.
Moreover, the agrochemical sector has leveraged 1,6-Dibromohexane in the development of novel pesticides and herbicides. Its reactivity allows for the introduction of bioactive moieties that disrupt essential metabolic pathways in pests while minimizing environmental impact. This aligns with global efforts to create sustainable agricultural practices that reduce reliance on traditional chemical formulations.
The industrial applications of 1,6-Dibromohexane extend beyond pharmaceuticals and agrochemicals. It is also used in the manufacture of specialty chemicals such as flame retardants and plasticizers. These materials enhance the safety and performance of consumer products by imparting desirable properties like heat resistance and flexibility. The demand for high-performance materials continues to drive innovation in brominated compounds like 1,6-Dibromohexane, underscoring its importance in industrial chemistry.
From an environmental perspective, the handling and disposal of 1,6-Dibromohexane must be conducted with care due to its potential reactivity and persistence under certain conditions. Regulatory agencies recommend adherence to best practices in chemical management to ensure safety and minimize ecological impact. Advances in green chemistry have prompted investigations into more sustainable synthetic routes for brominated compounds, including alternative methods for producing 1,6-Dibromohexane that reduce waste and energy consumption.
In conclusion,1,6-Dibromohexane (CAS No: 629-03-8) is a multifaceted compound with broad applications across multiple scientific disciplines. Its role as an intermediate in organic synthesis underscores its significance in drug development、material science,and industrial chemistry。 As research continues to uncover new methodologies for utilizing this compound,its relevance is expected to grow further,contributing to advancements that benefit society while maintaining environmental stewardship.
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