(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid
TL;DR: (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid (CAS 858745-65-0) is a chemical compound with molecular formula C16H18O5 and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-butoxy-4-methyl-2-oxochromen-3-yl)acetic acid
Also Known As: EiM07-16709, (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid, 2-(7-butoxy-4-methyl-2-oxochromen-3-yl)acetic acid, 2-(7-BUTOXY-4-METHYL-2-OXO-2H-CHROMEN-3-YL)ACETIC ACID, 2-(7-butoxy-4-methyl-2-oxo-chromen-3-yl)acetic Acid
| Molecular Formula | C16H18O5 |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 2.90742 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.11542 |
| Heavy Atoms | 21 |
| Complexity | 714.4145 |
Chemical Identifiers
| CAS Number | 858745-65-0 |
|---|---|
| SMILES | CCCCOC1=CC2=C(C=C1)C(=C(C(=O)O2)CC(=O)O)C |
Product Overview
(7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid (CAS 858745-65-0), with molecular formula C16H18O5 and molecular weight 290.12 g/mol. IUPAC: 2-(7-butoxy-4-methyl-2-oxochromen-3-yl)acetic acid.
Chemical Property Profile of (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid
Property Insights of (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid
The XLogP value of 2.90742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid. Following Lipinski's Rule of Five, (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid has 1 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-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid?
The CAS number of (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid is 858745-65-0.
What is the molecular formula of (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid?
The molecular formula of (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid is C16H18O5.
What is the molecular weight of (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid?
The molecular weight of (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid is 290.12 g/mol.
Where can I buy (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid?
You can request a quote for (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (7-butoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.