Caprylaldehyd Thiosemicarbazone
TL;DR: Caprylaldehyd Thiosemicarbazone (CAS 14942-74-6) is a chemical compound with molecular formula C9H19N3S and molecular weight 201.12997 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(octylideneamino)thiourea
Also Known As: (octylideneamino)thiourea, [(Z)-octylideneamino]thiourea, Caprylaldehyd Thiosemicarbazone
Technical Specifications
| Molecular Formula | C9H19N3S |
| Molecular Weight | 201.12997 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 201.12997 Da |
| Heavy Atoms | 13 |
| Complexity | 157.0 |
| SMILES | CCCCCCCC=NNC(=S)N |
| InChIKey | ITIOFYWYVKZHCP-UHFFFAOYSA-N |
Chemical Property Profile of Caprylaldehyd Thiosemicarbazone
Property Insights of Caprylaldehyd Thiosemicarbazone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Caprylaldehyd Thiosemicarbazone. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Caprylaldehyd Thiosemicarbazone. Following Lipinski's Rule of Five, Caprylaldehyd Thiosemicarbazone 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
What is the CAS number of Caprylaldehyd Thiosemicarbazone?
The CAS number of Caprylaldehyd Thiosemicarbazone is 14942-74-6.
What is the molecular formula of Caprylaldehyd Thiosemicarbazone?
The molecular formula of Caprylaldehyd Thiosemicarbazone is C9H19N3S.
What is the molecular weight of Caprylaldehyd Thiosemicarbazone?
The molecular weight of Caprylaldehyd Thiosemicarbazone is 201.12997 g/mol.
Where can I buy Caprylaldehyd Thiosemicarbazone?
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Does CoreyChem offer custom synthesis for Caprylaldehyd Thiosemicarbazone?
Yes, CoreyChem provides custom synthesis services for Caprylaldehyd Thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.