Psoralen,4,4',5'-trimethyl
TL;DR: Psoralen,4,4',5'-trimethyl (CAS 13008-11-2) is a chemical compound with molecular formula C14H12O3 and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5-trimethylfuro[3,2-g]chromen-7-one
Also Known As: 2,3,5-Trimethyl-7H-furo[3,2-g]chromen-7-one, PSORALEN,4,4',5'-TRIMETHYL, 2,3,5-trimethylfuro[3,2-g]chromen-7-one, 7H-Furo[3,2-g][1]benzopyran-7-one, 2,3,5-trimethyl-, 2,3,5-Trimethyl-7H-furo[3,2-g][1]benzopyran-7-one
| Molecular Formula | C14H12O3 |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.07864 |
| Heavy Atoms | 17 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 13008-11-2 |
|---|---|
| SMILES | CC1=CC(=O)OC2=CC3=C(C=C12)C(=C(O3)C)C |
| InChIKey | KKDGKMBVFICGHW-UHFFFAOYSA-N |
Product Overview
Psoralen,4,4',5'-trimethyl (CAS 13008-11-2), with molecular formula C14H12O3 and molecular weight 228.08 g/mol. IUPAC: 2,3,5-trimethylfuro[3,2-g]chromen-7-one.
Chemical Property Profile of Psoralen,4,4',5'-trimethyl
Property Insights of Psoralen,4,4',5'-trimethyl
The XLogP value of 3.0 indicates that Psoralen,4,4',5'-trimethyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, Psoralen,4,4',5'-trimethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Psoralen,4,4',5'-trimethyl 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 Psoralen,4,4',5'-trimethyl?
The CAS number of Psoralen,4,4',5'-trimethyl is 13008-11-2.
What is the molecular formula of Psoralen,4,4',5'-trimethyl?
The molecular formula of Psoralen,4,4',5'-trimethyl is C14H12O3.
What is the molecular weight of Psoralen,4,4',5'-trimethyl?
The molecular weight of Psoralen,4,4',5'-trimethyl is 228.08 g/mol.
Where can I buy Psoralen,4,4',5'-trimethyl?
You can request a quote for Psoralen,4,4',5'-trimethyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Psoralen,4,4',5'-trimethyl?
Yes, KEHONG BIO provides custom synthesis services for Psoralen,4,4',5'-trimethyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.