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7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one
TL;DR: 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one (CAS 62000-69-5) 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-[(3-chlorophenyl)methoxy]-4-propylchromen-2-one
Also Known As: MixCom6_001371, 7-[(3-chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one, BIM-0031254.P001, 7-[(3-chlorophenyl)methoxy]-4-propylchromen-2-one, 7-[(3-Chlorophenyl)methoxy]-4-propyl-2H-1-benzopyran-2-one
| Molecular Formula | C19H17ClO3 |
|---|---|
| Molecular Weight | 328.09 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 328.0866 |
| Heavy Atoms | 23 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 62000-69-5 |
|---|---|
| SMILES | CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC(=CC=C3)Cl |
| InChIKey | YHOXNAMTLZDCMH-UHFFFAOYSA-N |
Product Overview
7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one (CAS 62000-69-5), with molecular formula C19H17ClO3 and molecular weight 328.09 g/mol. IUPAC: 7-[(3-chlorophenyl)methoxy]-4-propylchromen-2-one.
Chemical Property Profile of 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one
Property Insights of 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one
The XLogP value of 4.9 indicates that 7-[(3-Chlorobenzyl)oxy]-4-propyl-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 35.5 Ų, 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-[(3-Chlorobenzyl)oxy]-4-propyl-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-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one?
The CAS number of 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one is 62000-69-5.
What is the molecular formula of 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one?
The molecular formula of 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one is C19H17ClO3.
What is the molecular weight of 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one?
The molecular weight of 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one is 328.09 g/mol.
Where can I buy 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one?
You can request a quote for 7-[(3-Chlorobenzyl)oxy]-4-propyl-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-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-[(3-Chlorobenzyl)oxy]-4-propyl-2h-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.