Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride
TL;DR: Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride (CAS 93890-47-2) is a chemical compound with molecular formula C14H19ClOS and molecular weight 270.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methyl-4-prop-2-enoxyphenyl)thiolan-1-ium chloride
Also Known As: Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride, 1-(3-methyl-4-prop-2-enoxyphenyl)thiolan-1-ium chloride, Thiophenium, tetrahydro-1-[3-methyl-4-(2-propenyloxy)phenyl]-, chloride, 1-{3-Methyl-4-[(prop-2-en-1-yl)oxy]phenyl}thiolan-1-ium chloride, 1-(3-methyl-4-prop-2-enoxy-phenyl)-2,3,4,5-tetrahydrothiophene Chloride
| Molecular Formula | C14H19ClOS |
|---|---|
| Molecular Weight | 270.08 g/mol |
| LogP | 0.33482 |
| Topological Polar Surface Area | 10.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.0845 |
| Heavy Atoms | 17 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 93890-47-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[S+]2CCCC2)OCC=C.[Cl-] |
| InChIKey | PKIANPAAHXLCKJ-UHFFFAOYSA-M |
Product Overview
Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride (CAS 93890-47-2), with molecular formula C14H19ClOS and molecular weight 270.08 g/mol. IUPAC: 1-(3-methyl-4-prop-2-enoxyphenyl)thiolan-1-ium chloride.
Chemical Property Profile of Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride
Property Insights of Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride
The XLogP value of 0.33482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride. With a topological polar surface area (TPSA) of 10.2 Ų, Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride has 0 hydrogen bond donor(s) and 2 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 Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride?
The CAS number of Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride is 93890-47-2.
What is the molecular formula of Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride?
The molecular formula of Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride is C14H19ClOS.
What is the molecular weight of Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride?
The molecular weight of Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride is 270.08 g/mol.
Where can I buy Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride?
You can request a quote for Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Thiophenium, tetrahydro-1-(3-methyl-4-(2-propenyloxy)phenyl)-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.