2-Hydroxy-4-isooctoxybenzophenone
TL;DR: 2-Hydroxy-4-isooctoxybenzophenone (CAS 33059-05-1) is a chemical compound with molecular formula C21H26O3 and molecular weight 326.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hydroxy-4-(6-methylheptoxy)phenyl]-phenylmethanone
Also Known As: 2-Hydroxy-4-isooctoxybenzophenone, 2-Hydroxy-4-(isooctoxy)benzophenone, 2-hydroxy-4- benzophenone, Methanone, (2-hydroxy-4-(isooctyloxy)phenyl)phenyl-, Methanone, [2-hydroxy-4-(isooctyloxy)phenyl]phenyl-
| Molecular Formula | C21H26O3 |
|---|---|
| Molecular Weight | 326.19 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 326.1882 |
| Heavy Atoms | 24 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 33059-05-1 |
|---|---|
| SMILES | CC(C)CCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O |
| InChIKey | HLVLKTYUBIGFFB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxy-4-isooctoxybenzophenone (CAS 33059-05-1), with molecular formula C21H26O3 and molecular weight 326.19 g/mol. IUPAC: [2-hydroxy-4-(6-methylheptoxy)phenyl]-phenylmethanone.
Chemical Property Profile of 2-Hydroxy-4-isooctoxybenzophenone
Property Insights of 2-Hydroxy-4-isooctoxybenzophenone
The XLogP value of 6.6 indicates that 2-Hydroxy-4-isooctoxybenzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Hydroxy-4-isooctoxybenzophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxy-4-isooctoxybenzophenone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Hydroxy-4-isooctoxybenzophenone?
The CAS number of 2-Hydroxy-4-isooctoxybenzophenone is 33059-05-1.
What is the molecular formula of 2-Hydroxy-4-isooctoxybenzophenone?
The molecular formula of 2-Hydroxy-4-isooctoxybenzophenone is C21H26O3.
What is the molecular weight of 2-Hydroxy-4-isooctoxybenzophenone?
The molecular weight of 2-Hydroxy-4-isooctoxybenzophenone is 326.19 g/mol.
Where can I buy 2-Hydroxy-4-isooctoxybenzophenone?
You can request a quote for 2-Hydroxy-4-isooctoxybenzophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-4-isooctoxybenzophenone?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-4-isooctoxybenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.