Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-
TL;DR: Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- (CAS 92014-81-8) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-aminoethyl)-6,7-dihydroxy-3H-2-benzofuran-1-one
Also Known As: PHTHALIDE, 3-(1-AMINOETHYL)-6,7-DIHYDROXY-, 3-(1-aminoethyl)-6,7-dihydroxy-3H-2-benzofuran-1-one, 3-(1-aminoethyl)-6,7-dihydroxy-3H-isobenzofuran-1-one, Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- (6CI,7CI)
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 0.6565 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 427.67572 |
Chemical Identifiers
| CAS Number | 92014-81-8 |
|---|---|
| SMILES | CC(C1C2=C(C(=C(C=C2)O)O)C(=O)O1)N |
Product Overview
Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- (CAS 92014-81-8), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: 3-(1-aminoethyl)-6,7-dihydroxy-3H-2-benzofuran-1-one.
Chemical Property Profile of Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-
Property Insights of Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-
The XLogP value of 0.6565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-. Following Lipinski's Rule of Five, Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- has 3 hydrogen bond donor(s) and 5 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 Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-?
The CAS number of Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- is 92014-81-8.
What is the molecular formula of Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-?
The molecular formula of Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- is C10H11NO4.
What is the molecular weight of Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-?
The molecular weight of Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- is 209.07 g/mol.
Where can I buy Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-?
You can request a quote for Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy-?
Yes, KEHONG BIO provides custom synthesis services for Phthalide, 3-(1-aminoethyl)-6,7-dihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.