Cas no 4938-52-7 (1-Hepten-3-ol)
1-Hepten-3-ol Chemical and Physical Properties
Names and Identifiers
-
- 1-Hepten-3-ol
- n-Butyl vinyl carbinol
- hept-1-en-3-ol
- 1-heptene-3-ol
- 3-hydroxyhept-1-ene
- Butyl vinyl carbinol
- heptene-1-ol-3
-
- MDL: MFCD00021940
- Inchi: 1S/C7H14O/c1-3-5-6-7(8)4-2/h4,7-8H,2-3,5-6H2,1H3
- InChI Key: PZKFYTOLVRCMOA-UHFFFAOYSA-N
- SMILES: CCCCC(C=C)O
- BRN: 1720340
Computed Properties
- Exact Mass: 114.10400
- Monoisotopic Mass: 114.104
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 59.4
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2
- Topological Polar Surface Area: 20.2A^2
Experimental Properties
- Color/Form: liquid
- Density: 0.836?g/mL?at 20?°C
0.836?g/mL?at 25?°C(lit.) - Melting Point: 26°C (estimate)
- Boiling Point: 153-156?°C(lit.)
- Flash Point: Fahrenheit: 129.2 ° f
Celsius: 54 ° c - Refractive Index: n20/D 1.433(lit.)
- Stability/Shelf Life: Stable. Flammable. Incompatible with strong oxidizing agents.
- PSA: 20.23000
- LogP: 1.72350
- Solubility: Uncertain
- FEMA: 4129 | (+/-)-1-HEPTEN-3-OL
1-Hepten-3-ol Security Information
-
Symbol:
- Signal Word:Warning
- Hazard Statement: H226-H315-H319-H335
- Warning Statement: P261-P305+P351+P338
- Hazardous Material transportation number:UN 1987 3/PG 3
- WGK Germany:3
- Hazard Category Code: 10-36/37/38
- Safety Instruction: S16-S26-S36/37/39
- FLUKA BRAND F CODES:10-23
-
Hazardous Material Identification:
- HazardClass:3
- PackingGroup:III
- TSCA:Yes
- Risk Phrases:R10
- Packing Group:III
- Safety Term:3
- Packing Group:III
- Hazard Level:3
1-Hepten-3-ol Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | H856845-10g |
1-Hepten-3-ol |
4938-52-7 | 98% | 10g |
684.00 | 2021-05-17 | |
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | W412901-SAMPLE |
1-Hepten-3-ol |
4938-52-7 | ≥98%, FG | 587.6 | 2021-05-17 | ||
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | W412901-25G |
1-Hepten-3-ol |
4938-52-7 | ≥98%, FG | 25G |
1882.52 | 2021-05-17 | |
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | W412901-100G |
1-Hepten-3-ol |
4938-52-7 | 100g |
¥3110.66 | 2023-11-12 | ||
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | SA00774-100g |
1-HEPTEN-3-OL |
4938-52-7 | ≥98% | 100g |
¥3788.0 | 2024-07-19 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | SA00774-25g |
1-HEPTEN-3-OL |
4938-52-7 | ≥98% | 25g |
¥1528.0 | 2024-07-19 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | SA00774-SAmPLE |
1-HEPTEN-3-OL |
4938-52-7 | ≥98% | sample |
¥538.0 | 2024-07-19 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | SA00473-1ml |
1-HEPTEN-3-OL |
4938-52-7 | 1ml |
¥818.0 | 2021-09-04 | ||
| A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI | A14651-10g |
1-Hepten-3-ol, 98% |
4938-52-7 | 98% | 10g |
¥643.00 | 2023-02-25 | |
| A FA AI SHA , SAI MO FEI SHI ER KE JI QI XIA GONG SI | A14651-50g |
1-Hepten-3-ol, 98% |
4938-52-7 | 98% | 50g |
¥2739.00 | 2023-02-25 |
1-Hepten-3-ol Suppliers
1-Hepten-3-ol Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
Related Categories
- Solvents and Organic Chemicals Organic Compounds Organic oxygen compounds Organooxygen compounds Secondary alcohols
- Solvents and Organic Chemicals Organic Compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Secondary alcohols
- Solvents and Organic Chemicals Organic Compounds Alcohol/Ether
Additional information on 1-Hepten-3-ol
Chemical Profile of 1-Hepten-3-ol (CAS No. 4938-52-7)
1-Hepten-3-ol, identified by the chemical compound code CAS No. 4938-52-7, is an organic compound belonging to the alcohol class. This linear aliphatic alcohol features a seven-carbon chain with a hydroxyl group (-OH) positioned at the third carbon, making it a secondary alcohol. The compound is characterized by its molecular formula, C7H14O, and exhibits a molecular weight of approximately 114.19 g/mol. 1-Hepten-3-ol is known for its distinctive fruity odor and is commonly utilized in various industrial and laboratory applications due to its unique chemical properties.
The synthesis of 1-Hepten-3-ol can be achieved through multiple pathways, with one of the most prominent methods being the reduction of heptanal or through the hydroformylation of 1-hexene. These synthetic routes highlight the compound's versatility in organic chemistry, allowing for its production under different conditions and scales. The compound's reactivity as a secondary alcohol makes it a valuable intermediate in the synthesis of more complex molecules, including esters, ethers, and other alcohols.
In recent years, 1-Hepten-3-ol has garnered attention in the field of specialty chemicals and pharmaceuticals. Its structural features make it a potential precursor in the development of bioactive compounds. For instance, researchers have explored its utility in generating derivatives that exhibit antimicrobial and anti-inflammatory properties. These studies leverage the compound's ability to undergo further functionalization, enabling the creation of novel molecules with therapeutic potential.
The role of 1-Hepten-3-ol in industrial applications is equally significant. It serves as a fragrance component in perfumes and cosmetics, where its pleasant aroma contributes to the sensory appeal of various products. Additionally, the compound is employed as an intermediate in the production of solvents and plasticizers, enhancing material properties in manufacturing processes. Its compatibility with other organic compounds makes it a preferred choice in formulating blends that require specific chemical behaviors.
From an environmental perspective, 1-Hepten-3-ol has been studied for its biodegradability and ecological impact. Research indicates that under certain conditions, the compound can be metabolized by microorganisms, suggesting a relatively low persistence in natural systems. This characteristic is particularly relevant in industries where environmental responsibility is a key concern, as it allows for the use of 1-Hepten-3-ol without significant long-term ecological risks.
The chemical reactivity of 1-Hepten-3-ol also positions it as a candidate for green chemistry initiatives. Its participation in catalytic processes that minimize waste and energy consumption aligns with sustainable practices. For example, enzymatic routes have been investigated for synthesizing 1-Hepten-3-ol, offering a more eco-friendly alternative to traditional chemical synthesis methods. Such advancements underscore the compound's importance not only as a chemical intermediate but also as a model for sustainable chemical manufacturing.
In conclusion, 1-Hepten-3-ol (CAS No. 4938-52-7) represents a multifaceted compound with broad applications across multiple sectors. Its unique structural attributes enable diverse synthetic pathways and functionalization opportunities, making it valuable in pharmaceutical research and industrial chemistry. Furthermore, its environmental profile supports its use in sustainable practices, reinforcing its relevance in modern chemical science.
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