(2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid
TL;DR: (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid (CAS 108695-20-1) is a chemical compound with molecular formula C20H24O2S and molecular weight 328.1497 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E,4E,6E)-7-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)-3-methylocta-2,4,6-trienoic acid
Also Known As: (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid, 2,4,6-Octatrienoic acid, 7-(3,4-dihydro-4,4-dimethyl-2H-1-benzothiopyran-6-yl)-3-methyl-, (E,E,E)-, 7-(4,4-Dimethyl-thiochroman-6-yl)-3-methyl-octa-2,4,6-trienoic acid, (2E,4E,6E)-7-(4,4-Dimethyl-thiochroman-6-yl)-3-methyl-octa-2,4,6-trienoic acid, (2E,4E,6E)-3-Methyl-7-[(3,4-dihydro-4,4-dimethyl-2H-1-benzothiopyran)-6-yl]-2,4,6-octatrienoic acid
Technical Specifications
| Molecular Formula | C20H24O2S |
| Molecular Weight | 328.1497 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.1497 Da |
| Heavy Atoms | 23 |
| Complexity | 528.0 |
| SMILES | C/C(=C\C(=O)O)/C=C/C=C(\C)/C1=CC2=C(C=C1)SCCC2(C)C |
| InChIKey | GAFLQIREHJATJD-ZFWGQPRBSA-N |
Chemical Property Profile of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid
Property Insights of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid
The XLogP value of 6.2 indicates that (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid. Following Lipinski's Rule of Five, (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid?
The CAS number of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid is 108695-20-1.
What is the molecular formula of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid?
The molecular formula of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid is C20H24O2S.
What is the molecular weight of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid?
The molecular weight of (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid is 328.1497 g/mol.
Where can I buy (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid?
You can request a quote for (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid?
Yes, CoreyChem provides custom synthesis services for (2E,4E,6E)-3,7-Dimethyl-7-(tetrahydro-4,4-dimethylthiochroman-6-yl)-2,4,6-heptatrienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.