Betaquil
TL;DR: Betaquil (CAS 709-90-0) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylpropan-2-yl carbamate
Also Known As: Betaquil, 1-phenylpropan-2-yl carbamate, Sa 217, CARBAMIC ACID, alpha-METHYLPHENETHYL ESTER, Carbamic acid alpha-methylphenethyl ester
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 709-90-0 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)OC(=O)N |
| InChIKey | QWJRGNMSAAHHJP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Betaquil (CAS 709-90-0), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: 1-phenylpropan-2-yl carbamate.
Chemical Property Profile of Betaquil
Property Insights of Betaquil
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Betaquil. With a topological polar surface area (TPSA) of 52.3 Ų, Betaquil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Betaquil 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
Frequently Asked Questions
What is the CAS number of Betaquil?
The CAS number of Betaquil is 709-90-0.
What is the molecular formula of Betaquil?
The molecular formula of Betaquil is C10H13NO2.
What is the molecular weight of Betaquil?
The molecular weight of Betaquil is 179.09 g/mol.
Where can I buy Betaquil?
You can request a quote for Betaquil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betaquil?
Yes, KEHONG BIO provides custom synthesis services for Betaquil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.