![(2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate structure](/static/products/1708/17089-08-6.webp)
(2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate
TL;DR: (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate (CAS 17089-08-6) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate
Also Known As: Santolina polyacetylene 18, NCI60_002550, NCI60_008411, [(2E)-2-hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-die, (3-hexa-2,4-diynylidene-4,9-dioxaspiro[4.4]nona-1,7-dien-6-yl) acetate
| Molecular Formula | C15H12O4 |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.07355 |
| Heavy Atoms | 19 |
| Complexity | 612.0 |
Chemical Identifiers
| CAS Number | 17089-08-6 |
|---|---|
| SMILES | CC#CC#CC=C1C=CC2(O1)C(C=CO2)OC(=O)C |
| InChIKey | XQVRVLVORPSYNU-UHFFFAOYSA-N |
Product Overview
(2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate (CAS 17089-08-6), with molecular formula C15H12O4 and molecular weight 256.07 g/mol. IUPAC: (2-hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate.
Chemical Property Profile of (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate
Property Insights of (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate. With a topological polar surface area (TPSA) of 44.8 Ų, (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate has 0 hydrogen bond donor(s) and 4 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 (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate?
The CAS number of (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate is 17089-08-6.
What is the molecular formula of (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate?
The molecular formula of (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate is C15H12O4.
What is the molecular weight of (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate?
The molecular weight of (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate is 256.07 g/mol.
Where can I buy (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate?
You can request a quote for (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (2-Hexa-2,4-diynylidene-1,6-dioxaspiro[4.4]nona-3,7-dien-9-yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.