Pibecarb
TL;DR: Pibecarb (CAS 2522-81-8) is a chemical compound with molecular formula C13H16O3 and molecular weight 220.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenacyl 2,2-dimethylpropanoate
Also Known As: Pibecarb, Phenacylpivalate, Pibecarbum, Pibecarbe, Pibecarbo
| Molecular Formula | C13H16O3 |
|---|---|
| Molecular Weight | 220.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.10994 |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 2522-81-8 |
|---|---|
| SMILES | CC(C)(C)C(=O)OCC(=O)C1=CC=CC=C1 |
| InChIKey | OTIZTAXUFMCICV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pibecarb (CAS 2522-81-8), with molecular formula C13H16O3 and molecular weight 220.11 g/mol. IUPAC: phenacyl 2,2-dimethylpropanoate.
Chemical Property Profile of Pibecarb
Property Insights of Pibecarb
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pibecarb. With a topological polar surface area (TPSA) of 43.4 Ų, Pibecarb exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pibecarb has 0 hydrogen bond donor(s) and 3 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 Pibecarb?
The CAS number of Pibecarb is 2522-81-8.
What is the molecular formula of Pibecarb?
The molecular formula of Pibecarb is C13H16O3.
What is the molecular weight of Pibecarb?
The molecular weight of Pibecarb is 220.11 g/mol.
Where can I buy Pibecarb?
You can request a quote for Pibecarb directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pibecarb?
Yes, KEHONG BIO provides custom synthesis services for Pibecarb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.