Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester
TL;DR: Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester (CAS 314743-99-2) is a chemical compound with molecular formula C16H14O6 and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9-acetyloxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) acetate
Also Known As: 4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromene-7,9-diyl diacetate, ACETIC ACID 9-ACETOXY-4-OXO-1,2,3,4-TETRAHYDRO-CYCLOPENTA(C)CHROMEN-7-YL ESTER, (9-acetyloxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) acetate, 7-(acetyloxy)-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl acetate
| Molecular Formula | C16H14O6 |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.07904 |
| Heavy Atoms | 22 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 314743-99-2 |
|---|---|
| SMILES | CC(=O)OC1=CC2=C(C3=C(CCC3)C(=O)O2)C(=C1)OC(=O)C |
| InChIKey | NBNIIYPYMWIMSV-UHFFFAOYSA-N |
Product Overview
Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester (CAS 314743-99-2), with molecular formula C16H14O6 and molecular weight 302.08 g/mol. IUPAC: (9-acetyloxy-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-yl) acetate.
Chemical Property Profile of Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester
Property Insights of Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester. Following Lipinski's Rule of Five, Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester has 0 hydrogen bond donor(s) and 6 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 Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester?
The CAS number of Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester is 314743-99-2.
What is the molecular formula of Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester?
The molecular formula of Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester is C16H14O6.
What is the molecular weight of Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester?
The molecular weight of Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester is 302.08 g/mol.
Where can I buy Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester?
You can request a quote for Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid 9-acetoxy-4-oxo-1,2,3,4-tetrahydro-cyclopenta(C)chromen-7-YL ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.