7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one
TL;DR: 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one (CAS 496875-34-4) is a chemical compound with molecular formula C18H18O3 and molecular weight 282.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-5-hydroxy-2,2-dimethyl-3H-chromen-4-one
Also Known As: 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one, 7-benzyl-5-hydroxy-2,2-dimethyl-3H-chromen-4-one, AN-970/40920660
| Molecular Formula | C18H18O3 |
|---|---|
| Molecular Weight | 282.13 g/mol |
| LogP | 3.7268 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.12558 |
| Heavy Atoms | 21 |
| Complexity | 687.1097 |
Chemical Identifiers
| CAS Number | 496875-34-4 |
|---|---|
| SMILES | CC1(CC(=O)C2=C(C=C(C=C2O1)CC3=CC=CC=C3)O)C |
Product Overview
7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one (CAS 496875-34-4), with molecular formula C18H18O3 and molecular weight 282.13 g/mol. IUPAC: 7-benzyl-5-hydroxy-2,2-dimethyl-3H-chromen-4-one.
Chemical Property Profile of 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one
Property Insights of 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one
The XLogP value of 3.7268 indicates that 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one 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 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one?
The CAS number of 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one is 496875-34-4.
What is the molecular formula of 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one?
The molecular formula of 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one is C18H18O3.
What is the molecular weight of 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one?
The molecular weight of 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one is 282.13 g/mol.
Where can I buy 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one?
You can request a quote for 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 7-benzyl-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.