1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride
TL;DR: 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride (CAS 6324-96-5) is a chemical compound with molecular formula C13H20ClN and molecular weight 225.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-3,4-dihydro-1H-isoquinoline;hydrochloride
Also Known As: NIOSH/NX4919070, 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride, 2-butyl-3,4-dihydro-1H-isoquinoline hydrochloride, Isoquinoline, 1,2,3,4-tetrahydro-2-butyl-, hydrochloride, 2-Butyl-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
| Molecular Formula | C13H20ClN |
|---|---|
| Molecular Weight | 225.13 g/mol |
| LogP | 3.2666 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.12843 |
| Heavy Atoms | 15 |
| Complexity | 298.34235 |
Chemical Identifiers
| CAS Number | 6324-96-5 |
|---|---|
| SMILES | CCCCN1CCC2=CC=CC=C2C1.Cl |
Product Overview
1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride (CAS 6324-96-5), with molecular formula C13H20ClN and molecular weight 225.13 g/mol. IUPAC: 2-butyl-3,4-dihydro-1H-isoquinoline;hydrochloride.
Chemical Property Profile of 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride
Property Insights of 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride
The XLogP value of 3.2666 indicates that 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride has 0 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 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride?
The CAS number of 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride is 6324-96-5.
What is the molecular formula of 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride?
The molecular formula of 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride is C13H20ClN.
What is the molecular weight of 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride?
The molecular weight of 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride is 225.13 g/mol.
Where can I buy 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride?
You can request a quote for 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydro-2-butylisoquinoline hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.