Thiocyanatomethanamine
TL;DR: Thiocyanatomethanamine (CAS 17139-92-3) is a chemical compound with molecular formula C2H4N2S and molecular weight 88.00952 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
aminomethyl thiocyanate
Also Known As: AMINOMETHYL THIOCYANATE, THIOCYANATOMETHANAMINE, Thiocyanic acid, aminomethyl ester
Technical Specifications
| Molecular Formula | C2H4N2S |
| Molecular Weight | 88.00952 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 75.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 88.00952 Da |
| Heavy Atoms | 5 |
| Complexity | 51.0 |
| SMILES | C(N)SC#N |
| InChIKey | ZMWJPDPNSLWMOS-UHFFFAOYSA-N |
Chemical Property Profile of Thiocyanatomethanamine
Property Insights of Thiocyanatomethanamine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiocyanatomethanamine. The TPSA of 75.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiocyanatomethanamine. Following Lipinski's Rule of Five, Thiocyanatomethanamine 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
What is the CAS number of Thiocyanatomethanamine?
The CAS number of Thiocyanatomethanamine is 17139-92-3.
What is the molecular formula of Thiocyanatomethanamine?
The molecular formula of Thiocyanatomethanamine is C2H4N2S.
What is the molecular weight of Thiocyanatomethanamine?
The molecular weight of Thiocyanatomethanamine is 88.00952 g/mol.
Where can I buy Thiocyanatomethanamine?
You can request a quote for Thiocyanatomethanamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thiocyanatomethanamine?
Yes, CoreyChem provides custom synthesis services for Thiocyanatomethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.