3-Butyl-4-methyl-2-oxochromen-7-yl propanoate
TL;DR: 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate (CAS 374700-99-9) is a chemical compound with molecular formula C17H20O4 and molecular weight 288.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-butyl-4-methyl-2-oxochromen-7-yl) propanoate
Also Known As: 3-butyl-4-methyl-2-oxochromen-7-yl propanoate, (3-butyl-4-methyl-2-oxochromen-7-yl) propanoate, 3-butyl-4-methyl-2-oxo-2H-chromen-7-yl propanoate, 3-butyl-4-methyl-2-oxo-2H-chromen-7-yl propionate
| Molecular Formula | C17H20O4 |
|---|---|
| Molecular Weight | 288.14 g/mol |
| LogP | 3.75942 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.13617 |
| Heavy Atoms | 21 |
| Complexity | 712.5373 |
Chemical Identifiers
| CAS Number | 374700-99-9 |
|---|---|
| SMILES | CCCCC1=C(C2=C(C=C(C=C2)OC(=O)CC)OC1=O)C |
Product Overview
3-Butyl-4-methyl-2-oxochromen-7-yl propanoate (CAS 374700-99-9), with molecular formula C17H20O4 and molecular weight 288.14 g/mol. IUPAC: (3-butyl-4-methyl-2-oxochromen-7-yl) propanoate.
Chemical Property Profile of 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate
Property Insights of 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate
The XLogP value of 3.75942 indicates that 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate 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 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate?
The CAS number of 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate is 374700-99-9.
What is the molecular formula of 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate?
The molecular formula of 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate is C17H20O4.
What is the molecular weight of 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate?
The molecular weight of 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate is 288.14 g/mol.
Where can I buy 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate?
You can request a quote for 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Butyl-4-methyl-2-oxochromen-7-yl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.