Carbamimidothioic acid, 10-undecenyl ester, monohydriodide
TL;DR: Carbamimidothioic acid, 10-undecenyl ester, monohydriodide (CAS 22584-04-9) is a chemical compound with molecular formula C12H25IN2S and molecular weight 356.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
undec-10-enyl carbamimidothioate;hydroiodide
Also Known As: ISOTHIURONIUM, Isothiouronium, Isothiouronium iodide salt, 2-Undec-10-enylisothiouronium iodide, Carbamimidothioic acid, 10-undecenyl ester, monohydriodide
| Molecular Formula | C12H25IN2S |
|---|---|
| Molecular Weight | 356.08 g/mol |
| LogP | 4.54 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 356.0783 |
| Heavy Atoms | 16 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 22584-04-9 |
|---|---|
| SMILES | C=CCCCCCCCCCSC(=N)N.I |
| InChIKey | INDZTCRIYSRWOH-UHFFFAOYSA-N |
Product Overview
Carbamimidothioic acid, 10-undecenyl ester, monohydriodide (CAS 22584-04-9), with molecular formula C12H25IN2S and molecular weight 356.08 g/mol. IUPAC: undec-10-enyl carbamimidothioate;hydroiodide.
Chemical Property Profile of Carbamimidothioic acid, 10-undecenyl ester, monohydriodide
Property Insights of Carbamimidothioic acid, 10-undecenyl ester, monohydriodide
The XLogP value of 4.54 indicates that Carbamimidothioic acid, 10-undecenyl ester, monohydriodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamimidothioic acid, 10-undecenyl ester, monohydriodide. Following Lipinski's Rule of Five, Carbamimidothioic acid, 10-undecenyl ester, monohydriodide has 3 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 Carbamimidothioic acid, 10-undecenyl ester, monohydriodide?
The CAS number of Carbamimidothioic acid, 10-undecenyl ester, monohydriodide is 22584-04-9.
What is the molecular formula of Carbamimidothioic acid, 10-undecenyl ester, monohydriodide?
The molecular formula of Carbamimidothioic acid, 10-undecenyl ester, monohydriodide is C12H25IN2S.
What is the molecular weight of Carbamimidothioic acid, 10-undecenyl ester, monohydriodide?
The molecular weight of Carbamimidothioic acid, 10-undecenyl ester, monohydriodide is 356.08 g/mol.
Where can I buy Carbamimidothioic acid, 10-undecenyl ester, monohydriodide?
You can request a quote for Carbamimidothioic acid, 10-undecenyl ester, monohydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamimidothioic acid, 10-undecenyl ester, monohydriodide?
Yes, KEHONG BIO provides custom synthesis services for Carbamimidothioic acid, 10-undecenyl ester, monohydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.