Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride
TL;DR: Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride (CAS 102395-77-7) is a chemical compound with molecular formula C12H16ClN and molecular weight 209.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclopropyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
Also Known As: N-Cyclopropyl-1,2,3,4-tetrahydroisoquinoline hydrochloride, 2-cyclopropyl-3,4-dihydro-1H-isoquinoline,chloride, 2-cyclopropyl-1,2,3,4-tetrahydroisoquinolin-2-ium;chloride, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-2-CYCLOPROPYL-, HYDROCHLORIDE, 2-cyclopropyl-1,2,3,4-tetrahydroisoquinolinium chloride
| Molecular Formula | C12H16ClN |
|---|---|
| Molecular Weight | 209.10 g/mol |
| LogP | -2.21 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.09712 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 102395-77-7 |
|---|---|
| SMILES | C1CC1[NH+]2CCC3=CC=CC=C3C2.[Cl-] |
| InChIKey | PMYZSAYZMPTCML-UHFFFAOYSA-N |
Product Overview
Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride (CAS 102395-77-7), with molecular formula C12H16ClN and molecular weight 209.10 g/mol. IUPAC: 2-cyclopropyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride.
Chemical Property Profile of Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride
Property Insights of Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride
The XLogP value of -2.21 indicates that Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride 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, Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride 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 Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride?
The CAS number of Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride is 102395-77-7.
What is the molecular formula of Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride?
The molecular formula of Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride is C12H16ClN.
What is the molecular weight of Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride?
The molecular weight of Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride is 209.10 g/mol.
Where can I buy Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride?
You can request a quote for Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoquinoline, 1,2,3,4-tetrahydro-2-cyclopropyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.