2-Aminoethyl thiocyanate--hydrogen bromide (1/1)
TL;DR: 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) (CAS 73908-95-9) is a chemical compound with molecular formula C3H7BrN2S and molecular weight 181.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethyl thiocyanate;hydrobromide
Also Known As: 2-Aminoethylthiocyanate hydrobromide, 2-aminoethyl thiocyanate hydrobromide, Thiocyanic acid, 2-aminoethyl ester, hydrobromide, 2-Aminoethyl thiocyanate--hydrogen bromide (1/1), Thiocyanic acid, 2-aminoethyl ester, monohydrobromide
| Molecular Formula | C3H7BrN2S |
|---|---|
| Molecular Weight | 181.95 g/mol |
| LogP | 0.73728 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 181.95132 |
| Heavy Atoms | 7 |
| Complexity | 60.445473 |
Chemical Identifiers
| CAS Number | 73908-95-9 |
|---|---|
| SMILES | C(CSC#N)N.Br |
Product Overview
2-Aminoethyl thiocyanate--hydrogen bromide (1/1) (CAS 73908-95-9), with molecular formula C3H7BrN2S and molecular weight 181.95 g/mol. IUPAC: 2-aminoethyl thiocyanate;hydrobromide.
Chemical Property Profile of 2-Aminoethyl thiocyanate--hydrogen bromide (1/1)
Property Insights of 2-Aminoethyl thiocyanate--hydrogen bromide (1/1)
The XLogP value of 0.73728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Aminoethyl thiocyanate--hydrogen bromide (1/1). With a topological polar surface area (TPSA) of 49.81 Ų, 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) 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 2-Aminoethyl thiocyanate--hydrogen bromide (1/1)?
The CAS number of 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) is 73908-95-9.
What is the molecular formula of 2-Aminoethyl thiocyanate--hydrogen bromide (1/1)?
The molecular formula of 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) is C3H7BrN2S.
What is the molecular weight of 2-Aminoethyl thiocyanate--hydrogen bromide (1/1)?
The molecular weight of 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) is 181.95 g/mol.
Where can I buy 2-Aminoethyl thiocyanate--hydrogen bromide (1/1)?
You can request a quote for 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Aminoethyl thiocyanate--hydrogen bromide (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Aminoethyl thiocyanate--hydrogen bromide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.