2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid
TL;DR: 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid (CAS 7145-43-9) is a chemical compound with molecular formula C3H4F3N3S and molecular weight 171.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,2-trifluoroethylideneamino)thiourea
Also Known As: NCIOpen2_000430, (2,2,2-trifluoroethylideneamino)thiourea, [(E)-2,2,2-trifluoroethylideneamino]thiourea, 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid
| Molecular Formula | C3H4F3N3S |
|---|---|
| Molecular Weight | 171.01 g/mol |
| LogP | 0.3677 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.0078 |
| Heavy Atoms | 10 |
| Complexity | 151.56215 |
Chemical Identifiers
| CAS Number | 7145-43-9 |
|---|---|
| SMILES | C(=NNC(=S)N)C(F)(F)F |
Product Overview
2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid (CAS 7145-43-9), with molecular formula C3H4F3N3S and molecular weight 171.01 g/mol. IUPAC: (2,2,2-trifluoroethylideneamino)thiourea.
Chemical Property Profile of 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid
Property Insights of 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid
The XLogP value of 0.3677 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid. With a topological polar surface area (TPSA) of 50.41 Ų, 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid has 2 hydrogen bond donor(s) and 2 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-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid?
The CAS number of 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid is 7145-43-9.
What is the molecular formula of 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid?
The molecular formula of 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid is C3H4F3N3S.
What is the molecular weight of 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid?
The molecular weight of 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid is 171.01 g/mol.
Where can I buy 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid?
You can request a quote for 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2,2-Trifluoroethylidene)hydrazine-1-carboximidothioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.