3-(Aminomethyl)-1lambda6-thiolane-1,1-dione
TL;DR: 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione (CAS 45697-13-0) is a chemical compound with molecular formula C5H11NO2S and molecular weight 149.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,1-dioxothiolan-3-yl)methanamine
Also Known As: 3-(Aminomethyl)tetrahydrothiophene 1,1-dioxide, (1,1-dioxothiolan-3-yl)methanamine, C- -METHYLAMINE, [(1,1-Dioxidotetrahydro-3-thienyl)methyl]amine, (1,1-DIOXOTETRAHYDROTHIOPHEN-3-YL)METHAMINE
| Molecular Formula | C5H11NO2S |
|---|---|
| Molecular Weight | 149.05 g/mol |
| LogP | -0.6202 |
| Topological Polar Surface Area | 60.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.05106 |
| Heavy Atoms | 9 |
| Complexity | 185.13467 |
Chemical Identifiers
| CAS Number | 45697-13-0 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1CN |
Product Overview
3-(Aminomethyl)-1lambda6-thiolane-1,1-dione (CAS 45697-13-0), with molecular formula C5H11NO2S and molecular weight 149.05 g/mol. IUPAC: (1,1-dioxothiolan-3-yl)methanamine.
Chemical Property Profile of 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione
Property Insights of 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione
The XLogP value of -0.6202 indicates that 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione. Following Lipinski's Rule of Five, 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione has 1 hydrogen bond donor(s) and 3 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 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione?
The CAS number of 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione is 45697-13-0.
What is the molecular formula of 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione?
The molecular formula of 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione is C5H11NO2S.
What is the molecular weight of 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione?
The molecular weight of 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione is 149.05 g/mol.
Where can I buy 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione?
You can request a quote for 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(Aminomethyl)-1lambda6-thiolane-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.