2-Propenoic acid, 3-phenyl-
TL;DR: 2-Propenoic acid, 3-phenyl- (CAS 621-82-9) is a chemical compound with molecular formula C9H8O2 and molecular weight 148.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenylprop-2-enoic acid
Also Known As: CINNAMIC ACID, TRANS-CINNAMIC ACID, heparin, Zimtsaeure, Cinnamylic acid
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H8O2 |
| Molecular Weight | 148.05243 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 148.05243 Da |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
| SMILES | C1=CC=C(C=C1)C=CC(=O)O |
| InChIKey | WBYWAXJHAXSJNI-UHFFFAOYSA-N |
Product Description
Applications: 2-Propenoic acid, 3-phenyl- is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2-Propenoic acid, 3-phenyl- (CAS 621-82-9) is a pharmaceutical intermediate with the molecular formula C9H8O2 and a molecular weight of 148.05 g/mol. Synonyms include CINNAMIC ACID and TRANS-CINNAMIC ACID.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Propenoic acid, 3-phenyl-
Property Insights of 2-Propenoic acid, 3-phenyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 3-phenyl-. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Propenoic acid, 3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-phenyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Propenoic acid, 3-phenyl-?
The CAS number of 2-Propenoic acid, 3-phenyl- is 621-82-9.
What is the molecular formula of 2-Propenoic acid, 3-phenyl-?
The molecular formula of 2-Propenoic acid, 3-phenyl- is C9H8O2.
What is the molecular weight of 2-Propenoic acid, 3-phenyl-?
The molecular weight of 2-Propenoic acid, 3-phenyl- is 148.05243 g/mol.
What are the applications of 2-Propenoic acid, 3-phenyl-?
2-Propenoic acid, 3-phenyl- is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy 2-Propenoic acid, 3-phenyl-?
You can request a quote for 2-Propenoic acid, 3-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propenoic acid, 3-phenyl-?
Yes, CoreyChem provides custom synthesis services for 2-Propenoic acid, 3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.