Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)
TL;DR: Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) (CAS 13893-13-5) is a chemical compound with molecular formula C7H15NO3S2 and molecular weight 225.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-1-(sulfosulfanylmethyl)cyclohexane
Also Known As: S-1-Aminocyclohexanemethylthiosulfuric acid, 1-amino-1-(sulfosulfanylmethyl)cyclohexane, Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester), Thiosulfuric acid, S-(1-amino-1-cyclohexylmethyl) ester, {[(1-aminocyclohexyl)methyl]sulfanyl}sulfonic acid
| Molecular Formula | C7H15NO3S2 |
|---|---|
| Molecular Weight | 225.05 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.04933 |
| Heavy Atoms | 13 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 13893-13-5 |
|---|---|
| SMILES | C1CCC(CC1)(CSS(=O)(=O)O)N |
| InChIKey | LPGUQYVNJVQJBE-UHFFFAOYSA-N |
Product Overview
Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) (CAS 13893-13-5), with molecular formula C7H15NO3S2 and molecular weight 225.05 g/mol. IUPAC: 1-amino-1-(sulfosulfanylmethyl)cyclohexane.
Chemical Property Profile of Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)
Property Insights of Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)
The XLogP value of -2.0 indicates that Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester). Following Lipinski's Rule of Five, Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) has 2 hydrogen bond donor(s) and 5 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 Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)?
The CAS number of Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) is 13893-13-5.
What is the molecular formula of Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)?
The molecular formula of Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) is C7H15NO3S2.
What is the molecular weight of Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)?
The molecular weight of Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) is 225.05 g/mol.
Where can I buy Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)?
You can request a quote for Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Methanethiol, (1-amino-1-cyclohexyl)-, hydrogen sulfate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.