2-(Dimethylamino)ethyl thiocyanate
TL;DR: 2-(Dimethylamino)ethyl thiocyanate (CAS 103114-48-3) is a chemical compound with molecular formula C5H10N2S and molecular weight 130.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl thiocyanate
Also Known As: 2-(dimethylamino)ethyl thiocyanate, 2-dimethylaminoethyl thiocyanate, 2-Thiocyanato-N,N-dimethylethylamin, N,N-dimethyl-2-thiocyanato-ethanamine
| Molecular Formula | C5H10N2S |
|---|---|
| Molecular Weight | 130.06 g/mol |
| LogP | 0.76228 |
| Topological Polar Surface Area | 27.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.05647 |
| Heavy Atoms | 8 |
| Complexity | 84.919685 |
Chemical Identifiers
| CAS Number | 103114-48-3 |
|---|---|
| SMILES | CN(C)CCSC#N |
Product Overview
2-(Dimethylamino)ethyl thiocyanate (CAS 103114-48-3), with molecular formula C5H10N2S and molecular weight 130.06 g/mol. IUPAC: 2-(dimethylamino)ethyl thiocyanate.
Chemical Property Profile of 2-(Dimethylamino)ethyl thiocyanate
Property Insights of 2-(Dimethylamino)ethyl thiocyanate
The XLogP value of 0.76228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)ethyl thiocyanate. With a topological polar surface area (TPSA) of 27.03 Ų, 2-(Dimethylamino)ethyl thiocyanate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl thiocyanate has 0 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 2-(Dimethylamino)ethyl thiocyanate?
The CAS number of 2-(Dimethylamino)ethyl thiocyanate is 103114-48-3.
What is the molecular formula of 2-(Dimethylamino)ethyl thiocyanate?
The molecular formula of 2-(Dimethylamino)ethyl thiocyanate is C5H10N2S.
What is the molecular weight of 2-(Dimethylamino)ethyl thiocyanate?
The molecular weight of 2-(Dimethylamino)ethyl thiocyanate is 130.06 g/mol.
Where can I buy 2-(Dimethylamino)ethyl thiocyanate?
You can request a quote for 2-(Dimethylamino)ethyl thiocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethylamino)ethyl thiocyanate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)ethyl thiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.