8,17-Epoxylabd-12-ene-15,16-dial
TL;DR: 8,17-Epoxylabd-12-ene-15,16-dial (CAS 119945-56-1) is a chemical compound with molecular formula C20H30O3 and molecular weight 318.21948 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-2-[2-[(1S,4aR,8aR)-5,5,8a-trimethylspiro[3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,2'-oxirane]-1-yl]ethylidene]butanedial
Also Known As: ZT-Dial, Aframodial, 8,17-Epoxylabd-12-ene-15,16-dial, (2E)-2-[2-[(1S,4aR,8aR)-5,5,8a-trimethylspiro[3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,2'-oxirane]-1-yl]ethylidene]butanedial, DL-Tyrosine, N-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]-
Technical Specifications
| Molecular Formula | C20H30O3 |
| Molecular Weight | 318.21948 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 46.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.21948 Da |
| Heavy Atoms | 23 |
| Complexity | 521.0 |
| SMILES | C[C@@]12CCCC([C@H]1CCC3([C@H]2C/C=C(\CC=O)/C=O)CO3)(C)C |
| InChIKey | ZAWCPGMKVKTLKI-SPCHKEILSA-N |
Chemical Property Profile of 8,17-Epoxylabd-12-ene-15,16-dial
Property Insights of 8,17-Epoxylabd-12-ene-15,16-dial
The XLogP value of 3.6 indicates that 8,17-Epoxylabd-12-ene-15,16-dial is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.7 Ų, 8,17-Epoxylabd-12-ene-15,16-dial exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8,17-Epoxylabd-12-ene-15,16-dial has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 8,17-Epoxylabd-12-ene-15,16-dial?
The CAS number of 8,17-Epoxylabd-12-ene-15,16-dial is 119945-56-1.
What is the molecular formula of 8,17-Epoxylabd-12-ene-15,16-dial?
The molecular formula of 8,17-Epoxylabd-12-ene-15,16-dial is C20H30O3.
What is the molecular weight of 8,17-Epoxylabd-12-ene-15,16-dial?
The molecular weight of 8,17-Epoxylabd-12-ene-15,16-dial is 318.21948 g/mol.
Where can I buy 8,17-Epoxylabd-12-ene-15,16-dial?
You can request a quote for 8,17-Epoxylabd-12-ene-15,16-dial directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8,17-Epoxylabd-12-ene-15,16-dial?
Yes, CoreyChem provides custom synthesis services for 8,17-Epoxylabd-12-ene-15,16-dial and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.