BS 6181
TL;DR: BS 6181 (CAS 16032-05-6) is a chemical compound with molecular formula C20H24O3 and molecular weight 312.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethylbutyl 2-hydroxy-2,2-diphenylacetate
Also Known As: BS 6181, 3,3-dimethylbutyl 2-hydroxy-2,2-diphenylacetate, 3,3-Dimethylbutyl alpha-hydroxy-alpha-phenylbenzeneacetate, 3,3-Dimethylbutyl hydroxydi(phenyl)acetate, Diphenylglycolic acid 3,3-dimethylbutyl ester
| Molecular Formula | C20H24O3 |
|---|---|
| Molecular Weight | 312.17 g/mol |
| LogP | 3.9019 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.17255 |
| Heavy Atoms | 23 |
| Complexity | 587.4413 |
Chemical Identifiers
| CAS Number | 16032-05-6 |
|---|---|
| SMILES | CC(C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O |
Product Overview
BS 6181 (CAS 16032-05-6), with molecular formula C20H24O3 and molecular weight 312.17 g/mol. IUPAC: 3,3-dimethylbutyl 2-hydroxy-2,2-diphenylacetate.
Chemical Property Profile of BS 6181
Property Insights of BS 6181
The XLogP value of 3.9019 indicates that BS 6181 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, BS 6181 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BS 6181 has 1 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 BS 6181?
The CAS number of BS 6181 is 16032-05-6.
What is the molecular formula of BS 6181?
The molecular formula of BS 6181 is C20H24O3.
What is the molecular weight of BS 6181?
The molecular weight of BS 6181 is 312.17 g/mol.
Where can I buy BS 6181?
You can request a quote for BS 6181 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BS 6181?
Yes, KEHONG BIO provides custom synthesis services for BS 6181 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.