Cas no 50555-04-9 (2-Propen-1-ol, 3-phenyl-, benzoate, (E)-)
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-ol, 3-phenyl-, benzoate, (E)-
- BRN 2109179
- 2-Propen-1-ol, 3-phenyl-, 1-benzoate
- Cinnamyl benzoate, >=98%, FG
- 3-Phenyl-2-propen-1-yl benzoate
- YD42CSO4W9
- WLN: RVO2U1R
- UARVBDPGNUHYQT-JXMROGBWSA-N
- CINNAMYLBENZOATE
- CINNAMYL BENZOATE [FHFI]
- trans-Cinnamyl benzoate
- 5320-75-2
- Cinnamyl benzoate [FIFH]
- Cinnamyl alcohol, benzoate
- C3650
- 2-Propen-1-ol, 3-phenyl-, 1-benzoate, (2E)-
- (2E)-3-phenylprop-2-en-1-yl benzoate
- (E)-3-phenylallyl benzoate
- NS00012094
- 2-Propen-1-ol, 3-phenyl-, benzoate, (2E)-
- (E)-cinnamyl benzoate
- AI3-36053
- Cinnamyl benzoate
- AKOS004905721
- UNII-YD42CSO4W9
- DTXSID501262614
- EINECS 226-180-2
- 2-09-00-00103 (Beilstein Handbook Reference)
- NSC245146
- NSC 245146
- MFCD00475021
- SCHEMBL382617
- CHEBI:174231
- 3-Phenyl-2-propenyl Benzoate
- 50555-04-9
- [(E)-3-phenylprop-2-enyl] benzoate
- NSC-245146
- CHEMBL1095237
- 2-Propen-1-ol, benzoate
- Benzoic acid, cinnamyl ester
- Q27294470
- FEMA NO. 4703
- Z2583146334
- 2-Propen-1-ol, 3-phenyl-, benzoate
- (e)-Cinnamyl benzoic acid
- trans-Cinnamyl benzoic acid
- (2E)-3-Phenylprop-2-en-1-yl benzoic acid
- Cinnamyl benzoic acid
- ((E)-3-phenylprop-2-enyl) benzoate
- Cinnamyl benzoate (FIFH)
-
- MDL: MFCD00475021
- Inchi: 1S/C16H14O2/c17-16(15-11-5-2-6-12-15)18-13-7-10-14-8-3-1-4-9-14/h1-12H,13H2/b10-7+
- InChI Key: UARVBDPGNUHYQT-JXMROGBWSA-N
- SMILES: O(C(C1C=CC=CC=1)=O)C/C=C/C1C=CC=CC=1
Computed Properties
- Exact Mass: 256.10998
- Monoisotopic Mass: 238.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 271
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 57.53
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | C3650-25G |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | 98.0%(GC) | 25G |
¥190.0 | 2022-09-28 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | C3650-100G |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | 98.0%(GC) | 100G |
¥590.0 | 2022-09-28 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | C3650-25G |
(E)-Cinnamyl Benzoate |
50555-04-9 | >98.0%(GC) | 25g |
¥175.00 | 2024-04-16 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | C3650-100G |
(E)-Cinnamyl Benzoate |
50555-04-9 | >98.0%(GC) | 100g |
¥535.00 | 2024-04-16 | |
| eNovation Chemicals LLC | D964405-100g |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | 98.0% | 100g |
$130 | 2024-06-05 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | C3650-25G |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | 98.0%(GC) | 25g |
¥190.0 | 2024-07-20 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | C3650-100G |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | 98.0%(GC) | 100g |
¥535.0 | 2024-07-20 | |
| 1PlusChem | 1P01GDV5-5g |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | >98.0%(GC) | 5g |
$42.00 | 2024-05-01 | |
| 1PlusChem | 1P01GDV5-25g |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | 98.0% | 25g |
$45.00 | 2024-05-01 | |
| 1PlusChem | 1P01GDV5-100g |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- |
50555-04-9 | 98.0% | 100g |
$97.00 | 2024-05-01 |
2-Propen-1-ol, 3-phenyl-, benzoate, (E)- Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
Additional information on 2-Propen-1-ol, 3-phenyl-, benzoate, (E)-
Compound CAS No 50555-04-9: 2-Propen-1-ol, 3-phenyl-, benzoate, (E)-
The compound with CAS No 50555-04-9, commonly referred to as 2-propen-1-ol, 3-phenyl-, benzoate, (E)-, is a significant molecule in the field of organic chemistry and materials science. This compound is characterized by its unique structure, which includes a phenyl group attached to a propenol backbone and a benzoate ester group. The (E)-configuration denotes the specific stereochemistry of the double bond in the molecule, which plays a crucial role in its physical and chemical properties.
Recent studies have highlighted the potential of 2-propen-1-ol, 3-phenyl-, benzoate, (E)- in various applications, particularly in the development of advanced materials and pharmaceuticals. Researchers have explored its ability to form self-assembled monolayers (SAMs) on surfaces, which is a critical property for applications in nanotechnology and surface engineering. The molecule's ability to undergo controlled polymerization has also been investigated, offering new avenues for the creation of functional polymers with tailored properties.
In the context of drug delivery systems, 2-propen-1-ol, 3-phenyl-, benzoate, (E)- has shown promise as a carrier molecule due to its biocompatibility and ability to encapsulate hydrophobic drugs. Studies have demonstrated that this compound can enhance drug solubility and stability, making it a valuable component in the formulation of targeted drug delivery systems. Furthermore, its compatibility with biological systems has been validated through in vitro experiments, suggesting potential applications in therapeutic treatments.
The synthesis of 2-propen-1-ol, 3-phenyl-, benzoate, (E)- has been optimized through green chemistry approaches, reducing environmental impact and improving yield. Novel synthetic pathways have been developed using catalytic asymmetric synthesis, enabling the production of enantiomerically pure compounds. This advancement is particularly important for pharmaceutical applications where stereochemistry is critical for efficacy and safety.
Recent advancements in computational chemistry have provided deeper insights into the electronic structure and reactivity of 2-propen-1-ol, 3-phenyl-, benzoate, (E)-. Quantum mechanical calculations have revealed that the molecule exhibits unique electronic properties due to conjugation effects between the phenyl ring and the benzoate group. These findings have implications for its use in optoelectronic devices and sensors.
In conclusion, 2-propen-1-ol, 3-phenyl-, benzoate, (E)- with CAS No 50555-04-9 is a versatile compound with a wide range of potential applications across multiple disciplines. Its unique structure and properties make it an invaluable tool for researchers in materials science, pharmacology, and nanotechnology. As ongoing research continues to uncover new functionalities and applications for this compound, it is poised to play an increasingly important role in both academic and industrial settings.
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