RefChem:1060411
TL;DR: RefChem:1060411 (CAS 53757-84-9) is a chemical compound with molecular formula C15H22ClN and molecular weight 251.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,9,9-trimethyl-1,2,3,4,4a,9a-hexahydroindeno[2,1-c]pyridin-2-ium chloride
Also Known As: 1H-Indeno(2,1-c)pyridine, 2,3,4,4a,9,9a-hexahydro-2,9,9-trimethyl-, hydrochloride, cis-(+-)-, cis-2,3,4,4a,9,9a-Hexahydro-2,9,9-trimethyl-1H-indeno(2,1-c)pyridine hydrochloride, trans-2,3,4,4a,9,9a-Hexahydro-2,9,9-trimethyl-1H-indeno(2,1-c)pyridine hydrochloride, 1H-Indeno(2,1-c)pyridine, 2,3,4,4a,9,9a-hexahydro-2,9,9-trimethyl-, hydrochloride, trans-(+-)-, 2,9,9-Trimethyl-1,2,3,4,4a,9a-hexahydroindeno[2,1-c]pyridin-2-iumchloride
| Molecular Formula | C15H22ClN |
|---|---|
| Molecular Weight | 251.14 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.14407 |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 53757-84-9 |
|---|---|
| SMILES | CC1(C2C[NH+](CCC2C3=CC=CC=C31)C)C.[Cl-] |
| InChIKey | MJHUETMMRFZKID-UHFFFAOYSA-N |
Product Overview
RefChem:1060411 (CAS 53757-84-9), with molecular formula C15H22ClN and molecular weight 251.14 g/mol. IUPAC: 2,9,9-trimethyl-1,2,3,4,4a,9a-hexahydroindeno[2,1-c]pyridin-2-ium chloride.
Chemical Property Profile of RefChem:1060411
Property Insights of RefChem:1060411
The XLogP value of -1.4 indicates that RefChem:1060411 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 4.4 Ų, RefChem:1060411 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1060411 has 1 hydrogen bond donor(s) and 1 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:1060411?
The CAS number of RefChem:1060411 is 53757-84-9.
What is the molecular formula of RefChem:1060411?
The molecular formula of RefChem:1060411 is C15H22ClN.
What is the molecular weight of RefChem:1060411?
The molecular weight of RefChem:1060411 is 251.14 g/mol.
Where can I buy RefChem:1060411?
You can request a quote for RefChem:1060411 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1060411?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1060411 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.