RefChem:1070496
TL;DR: RefChem:1070496 (CAS 63978-87-0) is a chemical compound with molecular formula C12H17ClINO and molecular weight 353.00433 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8-chloro-5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)-dimethylazanium iodide
Also Known As: 5-Naphthol, 8-chloro-1-(dimethylamino)-1,2,3,4-tetrahydro-, hydroiodide, N,N-Dimethyl-8-chloro-5-hydroxy-1,2,3,4-tetrahydro-1-naphthylamine hydroiodide, 1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-N,N-dimethyl-5-hydroxy-, hydroiodide, 1-Naphthylamine, 8-chloro-N,N-dimethyl-5-hydroxy-1,2,3,4-tetrahydro-, hydroiodide, 5-NAPHTHOL, 1,2,3,4-TETRAHYDRO-8-CHLORO-1-(DIMETHYLAMINO)-, HYDRIODIDE
Technical Specifications
| Molecular Formula | C12H17ClINO |
| Molecular Weight | 353.00433 g/mol |
| XLogP | -1.43 |
| Topological Polar Surface Area (TPSA) | 24.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 353.00433 Da |
| Heavy Atoms | 16 |
| Complexity | 222.0 |
| SMILES | C[NH+](C)C1CCCC2=C(C=CC(=C12)Cl)O.[I-] |
| InChIKey | MSZSMWMWASFRAA-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1070496
Property Insights of RefChem:1070496
The XLogP value of -1.43 indicates that RefChem:1070496 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 24.7 Ų, RefChem:1070496 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1070496 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 RefChem:1070496?
The CAS number of RefChem:1070496 is 63978-87-0.
What is the molecular formula of RefChem:1070496?
The molecular formula of RefChem:1070496 is C12H17ClINO.
What is the molecular weight of RefChem:1070496?
The molecular weight of RefChem:1070496 is 353.00433 g/mol.
Where can I buy RefChem:1070496?
You can request a quote for RefChem:1070496 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1070496?
Yes, CoreyChem provides custom synthesis services for RefChem:1070496 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.