RefChem:1061626
TL;DR: RefChem:1061626 (CAS 63979-18-0) is a chemical compound with molecular formula C17H26ClNO2 and molecular weight 311.1652 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl-[2-(1,2,3,4-tetrahydronaphthalene-1-carbonyloxy)ethyl]azanium chloride
Also Known As: 1-Naphthoic acid, 1,2,3,4-tetrahydro-, 2-(diethylamino)ethyl ester, hydrochloride, 1,2,3,4-Tetrahydro-1-naphthoic acid 2-(diethylamino)ethyl ester hydrochloride, 2-(Diethylamino)ethyl ester of 1,2,3,4-tetrahydro-1-naphthoic acid hydrochloride, DIETHYL-[2-(1,2,3,4-TETRAHYDRONAPHTHALENE-1-CARBONYLOXY)ETHYL]AZANIUMCHLORIDE, 2-(Diethylamino)ethyl 1,2,3,4-tetrahydronaphthalene-1-carboxylate--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C17H26ClNO2 |
| Molecular Weight | 311.1652 g/mol |
| XLogP | -1.42 |
| Topological Polar Surface Area (TPSA) | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 311.1652 Da |
| Heavy Atoms | 21 |
| Complexity | 301.0 |
| SMILES | CC[NH+](CC)CCOC(=O)C1CCCC2=CC=CC=C12.[Cl-] |
| InChIKey | WSYXBHSXXTWQIB-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1061626
Property Insights of RefChem:1061626
The XLogP value of -1.42 indicates that RefChem:1061626 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.7 Ų, RefChem:1061626 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1061626 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
What is the CAS number of RefChem:1061626?
The CAS number of RefChem:1061626 is 63979-18-0.
What is the molecular formula of RefChem:1061626?
The molecular formula of RefChem:1061626 is C17H26ClNO2.
What is the molecular weight of RefChem:1061626?
The molecular weight of RefChem:1061626 is 311.1652 g/mol.
Where can I buy RefChem:1061626?
You can request a quote for RefChem:1061626 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1061626?
Yes, CoreyChem provides custom synthesis services for RefChem:1061626 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.