7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one
TL;DR: 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one (CAS 428833-52-7) is a chemical compound with molecular formula C19H17ClO3 and molecular weight 328.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-chlorophenyl)methoxy]-3,4,8-trimethylchromen-2-one
Also Known As: 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one, 7-[(4-chlorophenyl)methoxy]-3,4,8-trimethylchromen-2-one, 7-((4-chlorobenzyl)oxy)-3,4,8-trimethyl-2H-chromen-2-one, 7-[(4-CHLOROPHENYL)METHOXY]-3,4,8-TRIMETHYL-2H-CHROMEN-2-ONE
| Molecular Formula | C19H17ClO3 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 4.95066 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.0866 |
| Heavy Atoms | 23 |
| Complexity | 923.983 |
Chemical Identifiers
| CAS Number | 428833-52-7 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(C=C3)Cl)C |
Product Overview
7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one (CAS 428833-52-7), with molecular formula C19H17ClO3 and molecular weight 328.09 g/mol. IUPAC: 7-[(4-chlorophenyl)methoxy]-3,4,8-trimethylchromen-2-one.
Chemical Property Profile of 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one
Property Insights of 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one
The XLogP value of 4.95066 indicates that 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.44 Ų, 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one 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 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one?
The CAS number of 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one is 428833-52-7.
What is the molecular formula of 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one?
The molecular formula of 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one is C19H17ClO3.
What is the molecular weight of 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one?
The molecular weight of 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one is 328.09 g/mol.
Where can I buy 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one?
You can request a quote for 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-[(4-chlorobenzyl)oxy]-3,4,8-trimethyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.