RefChem:1056069
TL;DR: RefChem:1056069 (CAS 64037-79-2) is a chemical compound with molecular formula C15H19Cl2NO and molecular weight 299.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-methyl-prop-2-ynylazanium chloride
Also Known As: 1-Naphthylamine, 1,2,3,4-tetrahydro-8-chloro-5-methoxy-N-methyl-N-(2-propynyl)-, hydrochloride, (8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-methyl-prop-2-ynylazanium chloride, 1-NAPHTHYLAMINE, 1,2,3,4-TETRAHYDRO-8-CHLORO-5-METHOXY-N-METHYL-N-(2-PROPYNYL)-,, 1-Naphthalenamine, 8-chloro-1,2,3,4-tetrahydro-5-methoxy-N-methyl-N-2-propynyl-, hydrochloride, RefChem:1056069
| Molecular Formula | C15H19Cl2NO |
|---|---|
| Molecular Weight | 299.08 g/mol |
| LogP | -1.12 |
| Topological Polar Surface Area | 13.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.08438 |
| Heavy Atoms | 19 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 64037-79-2 |
|---|---|
| SMILES | C[NH+](CC#C)C1CCCC2=C(C=CC(=C12)Cl)OC.[Cl-] |
| InChIKey | XZJXITQTLJLCIZ-UHFFFAOYSA-N |
Product Overview
RefChem:1056069 (CAS 64037-79-2), with molecular formula C15H19Cl2NO and molecular weight 299.08 g/mol. IUPAC: (8-chloro-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-methyl-prop-2-ynylazanium chloride.
Chemical Property Profile of RefChem:1056069
Property Insights of RefChem:1056069
The XLogP value of -1.12 indicates that RefChem:1056069 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 13.7 Ų, RefChem:1056069 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1056069 has 1 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 RefChem:1056069?
The CAS number of RefChem:1056069 is 64037-79-2.
What is the molecular formula of RefChem:1056069?
The molecular formula of RefChem:1056069 is C15H19Cl2NO.
What is the molecular weight of RefChem:1056069?
The molecular weight of RefChem:1056069 is 299.08 g/mol.
Where can I buy RefChem:1056069?
You can request a quote for RefChem:1056069 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056069?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056069 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.