![1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one structure](/static/products/5320/5320-48-9.webp)
1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one
TL;DR: 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one (CAS 5320-48-9) is a chemical compound with molecular formula C16H14O5 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one
Also Known As: 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one, 1,2,3,10-Tetrahydroxy-6,7-dihydrobenzo[a]heptalen-9(5H)-one
| Molecular Formula | C16H14O5 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 286.08414 |
| Heavy Atoms | 21 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 5320-48-9 |
|---|---|
| SMILES | C1CC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C3C1)O)O)O)O |
| InChIKey | QKTKUMGUTLAKEE-UHFFFAOYSA-N |
Product Overview
1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one (CAS 5320-48-9), with molecular formula C16H14O5 and molecular weight 286.08 g/mol. IUPAC: 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one.
Chemical Property Profile of 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one
Property Insights of 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one. Following Lipinski's Rule of Five, 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one has 4 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 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?
The CAS number of 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one is 5320-48-9.
What is the molecular formula of 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?
The molecular formula of 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one is C16H14O5.
What is the molecular weight of 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?
The molecular weight of 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one is 286.08 g/mol.
Where can I buy 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?
You can request a quote for 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,10-tetrahydroxy-6,7-dihydro-5H-benzo[a]heptalen-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.