4'-Methylangelicin
TL;DR: 4'-Methylangelicin (CAS 78982-40-8) is a chemical compound with molecular formula C12H8O3 and molecular weight 200.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methylfuro[2,3-h]chromen-2-one
Also Known As: 9-Methylangelicin, 4'-Methylangelicin, 9-methyl-2h-furo[2,3-h]chromen-2-one, 4 -Methylangelicin, 9-methylfuro[2,3-h]chromen-2-one
| Molecular Formula | C12H8O3 |
|---|---|
| Molecular Weight | 200.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.04735 |
| Heavy Atoms | 15 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 78982-40-8 |
|---|---|
| SMILES | CC1=COC2=C1C3=C(C=C2)C=CC(=O)O3 |
| InChIKey | NHOICFAHZSXGJY-UHFFFAOYSA-N |
Product Overview
4'-Methylangelicin (CAS 78982-40-8), with molecular formula C12H8O3 and molecular weight 200.05 g/mol. IUPAC: 9-methylfuro[2,3-h]chromen-2-one.
Chemical Property Profile of 4'-Methylangelicin
Property Insights of 4'-Methylangelicin
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4'-Methylangelicin. With a topological polar surface area (TPSA) of 39.4 Ų, 4'-Methylangelicin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4'-Methylangelicin 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 4'-Methylangelicin?
The CAS number of 4'-Methylangelicin is 78982-40-8.
What is the molecular formula of 4'-Methylangelicin?
The molecular formula of 4'-Methylangelicin is C12H8O3.
What is the molecular weight of 4'-Methylangelicin?
The molecular weight of 4'-Methylangelicin is 200.05 g/mol.
Where can I buy 4'-Methylangelicin?
You can request a quote for 4'-Methylangelicin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Methylangelicin?
Yes, KEHONG BIO provides custom synthesis services for 4'-Methylangelicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.