7-Amino-4,5,6-triethoxy-3-hydroxyphthalide
TL;DR: 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide (CAS 103658-71-5) is a chemical compound with molecular formula C14H19NO6 and molecular weight 297.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-amino-4,5,6-triethoxy-3-hydroxy-3H-2-benzofuran-1-one
Also Known As: HOEAP, 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide, 2-[(4-nitrophenyl)methyl]guanidine, 7-amino-4,5,6-triethoxy-3-hydroxy-3H-2-benzofuran-1-one, 1(3H)-Isobenzofuranone,7-amino-4,5,6-triethoxy-3-hydroxy-
| Molecular Formula | C14H19NO6 |
|---|---|
| Molecular Weight | 297.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 297.12125 |
| Heavy Atoms | 21 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 103658-71-5 |
|---|---|
| SMILES | CCOC1=C(C(=C(C2=C1C(OC2=O)O)N)OCC)OCC |
| InChIKey | WXROGYUKEGMRLK-UHFFFAOYSA-N |
Product Overview
7-Amino-4,5,6-triethoxy-3-hydroxyphthalide (CAS 103658-71-5), with molecular formula C14H19NO6 and molecular weight 297.12 g/mol. IUPAC: 7-amino-4,5,6-triethoxy-3-hydroxy-3H-2-benzofuran-1-one.
Chemical Property Profile of 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide
Property Insights of 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide. Following Lipinski's Rule of Five, 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide has 2 hydrogen bond donor(s) and 7 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-Amino-4,5,6-triethoxy-3-hydroxyphthalide?
The CAS number of 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide is 103658-71-5.
What is the molecular formula of 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide?
The molecular formula of 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide is C14H19NO6.
What is the molecular weight of 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide?
The molecular weight of 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide is 297.12 g/mol.
Where can I buy 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide?
You can request a quote for 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide?
Yes, KEHONG BIO provides custom synthesis services for 7-Amino-4,5,6-triethoxy-3-hydroxyphthalide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.