(dihydroxy-trimethyl-oxo-[?]yl) acetate
TL;DR: (dihydroxy-trimethyl-oxo-[?]yl) acetate (CAS 34737-52-5) is a chemical compound with molecular formula C20H24O7 and molecular weight 376.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11,12-dihydroxy-1,15,15-trimethyl-8-oxo-14,16-dioxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5-trien-6-yl) acetate
Also Known As: (dihydroxy-trimethyl-oxo-[?]yl) acetate, 1,2-diphenyl-1,2-dicyano-1,2-dimethylethane, Anthra(1,9-de)-1,3-dioxin-7(3aH)-one, 8-(acetyloxy)-4,5,6,6a,11b,11c-hexahydro-4,5-dihydroxy-2,2,11b-trimethyl-, Anthra(1,9-de)-m-dioxin-7(3aH)-one, 4,5,6,6a,11b,11c-hexahydro-4,5,8-trihydroxy-2,2,11b-trimethyl-, 8-acetate, Anthra[1,9-de]-1,3-dioxin-7(3aH)-one, 8-(acetyloxy)-4,5,6,6a,11b,11c-hexahydro-4,5-dihydroxy-2,2,11b-trimethyl-
| Molecular Formula | C20H24O7 |
|---|---|
| Molecular Weight | 376.15 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.1522 |
| Heavy Atoms | 27 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 34737-52-5 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC2=C1C(=O)C3CC(C(C4C3C2(OC(O4)(C)C)C)O)O |
| InChIKey | HHJKGFJSJRCMCF-UHFFFAOYSA-N |
Product Overview
(dihydroxy-trimethyl-oxo-[?]yl) acetate (CAS 34737-52-5), with molecular formula C20H24O7 and molecular weight 376.15 g/mol. IUPAC: (11,12-dihydroxy-1,15,15-trimethyl-8-oxo-14,16-dioxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5-trien-6-yl) acetate.
Chemical Property Profile of (dihydroxy-trimethyl-oxo-[?]yl) acetate
Property Insights of (dihydroxy-trimethyl-oxo-[?]yl) acetate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (dihydroxy-trimethyl-oxo-[?]yl) acetate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (dihydroxy-trimethyl-oxo-[?]yl) acetate. Following Lipinski's Rule of Five, (dihydroxy-trimethyl-oxo-[?]yl) acetate 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 (dihydroxy-trimethyl-oxo-[?]yl) acetate?
The CAS number of (dihydroxy-trimethyl-oxo-[?]yl) acetate is 34737-52-5.
What is the molecular formula of (dihydroxy-trimethyl-oxo-[?]yl) acetate?
The molecular formula of (dihydroxy-trimethyl-oxo-[?]yl) acetate is C20H24O7.
What is the molecular weight of (dihydroxy-trimethyl-oxo-[?]yl) acetate?
The molecular weight of (dihydroxy-trimethyl-oxo-[?]yl) acetate is 376.15 g/mol.
Where can I buy (dihydroxy-trimethyl-oxo-[?]yl) acetate?
You can request a quote for (dihydroxy-trimethyl-oxo-[?]yl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (dihydroxy-trimethyl-oxo-[?]yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (dihydroxy-trimethyl-oxo-[?]yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.