Phenyl but-2-enoate
TL;DR: Phenyl but-2-enoate (CAS 55673-53-5) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl but-2-enoate
Also Known As: Phenyl but-2-enoate, 2-Butenoic acid, phenyl ester, 2-Butenoic acid, phenyl ester, (2E)-
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.06808 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 55673-53-5 |
|---|---|
| SMILES | CC=CC(=O)OC1=CC=CC=C1 |
| InChIKey | TXSXJLMEOQAASX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenyl but-2-enoate (CAS 55673-53-5), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: phenyl but-2-enoate.
Chemical Property Profile of Phenyl but-2-enoate
Property Insights of Phenyl but-2-enoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl but-2-enoate. With a topological polar surface area (TPSA) of 26.3 Ų, Phenyl but-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl but-2-enoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenyl but-2-enoate?
The CAS number of Phenyl but-2-enoate is 55673-53-5.
What is the molecular formula of Phenyl but-2-enoate?
The molecular formula of Phenyl but-2-enoate is C10H10O2.
What is the molecular weight of Phenyl but-2-enoate?
The molecular weight of Phenyl but-2-enoate is 162.07 g/mol.
Where can I buy Phenyl but-2-enoate?
You can request a quote for Phenyl but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.