7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one
TL;DR: 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one (CAS 329907-50-8) is a chemical compound with molecular formula C21H20O4 and molecular weight 336.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3,3-dimethyl-2-oxobutoxy)-4-phenylchromen-2-one
Also Known As: EiM07-13090, BAS 02236073, 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one, BIM-0003335.P001, 7-(3,3-dimethyl-2-oxobutoxy)-4-phenylchromen-2-one
| Molecular Formula | C21H20O4 |
|---|---|
| Molecular Weight | 336.14 g/mol |
| LogP | 4.454 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.13617 |
| Heavy Atoms | 25 |
| Complexity | 962.5929 |
Chemical Identifiers
| CAS Number | 329907-50-8 |
|---|---|
| SMILES | CC(C)(C)C(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=CC=C3 |
Product Overview
7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one (CAS 329907-50-8), with molecular formula C21H20O4 and molecular weight 336.14 g/mol. IUPAC: 7-(3,3-dimethyl-2-oxobutoxy)-4-phenylchromen-2-one.
Chemical Property Profile of 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one
Property Insights of 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one
The XLogP value of 4.454 indicates that 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-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 56.51 Ų, 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one has 0 hydrogen bond donor(s) and 4 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-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one?
The CAS number of 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one is 329907-50-8.
What is the molecular formula of 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one?
The molecular formula of 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one is C21H20O4.
What is the molecular weight of 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one?
The molecular weight of 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one is 336.14 g/mol.
Where can I buy 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one?
You can request a quote for 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-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-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-(3,3-dimethyl-2-oxobutoxy)-4-phenyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.