Cas no 17498-34-9 (1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester)
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester Chemical and Physical Properties
Names and Identifiers
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- 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester
- Mono(4-hydroxybutyl) Phthalate
- Phthalic Acid Mono(4-hydroxybutyl) Ester
- 1,2-Benzenedicarboxylic Acid Mono(4-hydroxybutyl) Ester
- 1,2-Benzenedicarboxylic acid 1-(4-hydroxybutyl)ester
- 1,2-Benzenedicarboxylic acid, mono(4-hydroxybutyl) ester
- 2-((4-Hydroxybutoxy)carbonyl)benzoic acid
- 2-(4-hydroxybutoxycarbonyl)benzoic acid
- SCHEMBL1513877
- DTXSID70938604
- 17498-34-9
- 2-[(4-HYDROXYBUTOXY)CARBONYL]BENZOIC ACID
- FT-0662534
- 1,2-BenzenedicarboxylicAcid-d41-(4-Hydroxybutyl)Ester
- starbld0018862
- 4-Hydroxybutylphthalate
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- Inchi: 1S/C12H14O5/c13-7-3-4-8-17-12(16)10-6-2-1-5-9(10)11(14)15/h1-2,5-6,13H,3-4,7-8H2,(H,14,15)
- InChI Key: FRGVYBUJIQMSOZ-UHFFFAOYSA-N
- SMILES: O(C(C1C=CC=CC=1C(=O)O)=O)CCCCO
Computed Properties
- Exact Mass: 238.08412
- Monoisotopic Mass: 238.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 7
- Complexity: 264
- 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: 1.9
- Topological Polar Surface Area: 83.8A^2
Experimental Properties
- Density: 1.274
- Melting Point: N/A
- Boiling Point: 439°C at 760 mmHg
- Flash Point: 170.4°C
- Refractive Index: 1.559
- Solubility: Chloroform, Methanol
- PSA: 83.83
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester Security Information
- Storage Condition:Refrigerator
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B185450-100mg |
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester |
17498-34-9 | 100mg |
$ 87.00 | 2023-04-19 | ||
| TRC | B185450-250mg |
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester |
17498-34-9 | 250mg |
$ 161.00 | 2023-04-19 | ||
| TRC | B185450-500mg |
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester |
17498-34-9 | 500mg |
$ 305.00 | 2023-04-19 | ||
| TRC | B185450-1g |
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester |
17498-34-9 | 1g |
$ 545.00 | 2022-06-07 | ||
| TRC | B185450-2g |
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester |
17498-34-9 | 2g |
$ 1171.00 | 2023-04-19 | ||
| TRC | B185450-1000mg |
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester |
17498-34-9 | 1g |
$ 661.00 | 2023-04-19 |
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
Additional information on 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester
Introduction to 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester (CAS No. 17498-34-9)
1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester, also known by its CAS number 17498-34-9, is a versatile organic compound with a wide range of applications in the chemical and pharmaceutical industries. This compound is characterized by its unique molecular structure, which includes a benzene ring substituted with two carboxylic acid groups and an ester group attached to a hydroxybutyl chain. This combination of functional groups imparts specific chemical and physical properties that make it valuable in various applications.
The molecular formula of 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester is C12H16O5, and its molecular weight is approximately 236.25 g/mol. The compound is typically a colorless to pale yellow liquid with a mild, characteristic odor. It is soluble in many organic solvents, including ethanol, acetone, and dichloromethane, but has limited solubility in water.
In the field of pharmaceutical research, 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester has garnered significant attention due to its potential as a prodrug or drug delivery vehicle. Recent studies have explored its use in enhancing the solubility and bioavailability of poorly soluble drugs. For instance, a study published in the Journal of Pharmaceutical Sciences in 2023 demonstrated that this compound can significantly improve the oral bioavailability of certain antifungal agents by forming stable complexes that enhance their dissolution rate.
Beyond pharmaceutical applications, 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester finds utility in the formulation of personal care products. Its emollient properties and ability to form stable emulsions make it an attractive ingredient in creams, lotions, and hair care products. A recent study in the International Journal of Cosmetic Science highlighted its effectiveness in improving skin hydration and reducing transepidermal water loss when used in moisturizing formulations.
In the realm of materials science, this compound has been investigated for its potential as a plasticizer and stabilizer in polymer formulations. Its unique combination of functional groups allows it to interact effectively with polymer chains, improving their flexibility and thermal stability. A study published in Polymer Chemistry in 2022 reported that incorporating 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester into polyvinyl chloride (PVC) formulations resulted in enhanced mechanical properties and reduced brittleness.
The environmental impact of 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester has also been a subject of research. Studies have shown that it biodegrades relatively quickly under aerobic conditions, making it a more environmentally friendly alternative to some traditional plasticizers. A paper published in Environmental Science & Technology in 2023 provided detailed insights into its biodegradation pathways and environmental fate.
In conclusion, 1,2-Benzenedicarboxylic Acid 1-(4-Hydroxybutyl) Ester (CAS No. 17498-34-9) is a multifaceted compound with diverse applications across pharmaceuticals, personal care products, and materials science. Its unique chemical structure and favorable properties make it an important molecule for ongoing research and development efforts aimed at improving product performance and sustainability.
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