Aporphine, 10-fluoro-, hydrochloride
TL;DR: Aporphine, 10-fluoro-, hydrochloride (CAS 3833-87-2) is a chemical compound with molecular formula C17H17ClFN and molecular weight 289.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aS)-10-fluoro-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium chloride
Also Known As: 10-Fluoroaporphine hydrochloride, APORPHINE, 10-FLUORO-, HYDROCHLORIDE, Aporphine, 3-fluoro-, hydrochloride, 4H-Dibenzo(de,g)quinoline, 10-fluoro-5,6,6a,7-tetrahydro-6-methyl-, hydrochloride, 4H-Dibenzo(de,g)quinoline, 10-fluoro-5,6,6a,7-tetrahydro-6-methyl-, hydrochloride (9CI)
| Molecular Formula | C17H17ClFN |
|---|---|
| Molecular Weight | 289.10 g/mol |
| LogP | -0.84 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 289.10336 |
| Heavy Atoms | 20 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 3833-87-2 |
|---|---|
| SMILES | C[NH+]1CCC2=C3[C@@H]1CC4=C(C3=CC=C2)C=C(C=C4)F.[Cl-] |
| InChIKey | DFPOOSWSMBIVRQ-NTISSMGPSA-N |
Product Overview
Aporphine, 10-fluoro-, hydrochloride (CAS 3833-87-2), with molecular formula C17H17ClFN and molecular weight 289.10 g/mol. IUPAC: (6aS)-10-fluoro-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium chloride.
Chemical Property Profile of Aporphine, 10-fluoro-, hydrochloride
Property Insights of Aporphine, 10-fluoro-, hydrochloride
The XLogP value of -0.84 indicates that Aporphine, 10-fluoro-, 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, Aporphine, 10-fluoro-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aporphine, 10-fluoro-, hydrochloride 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 Aporphine, 10-fluoro-, hydrochloride?
The CAS number of Aporphine, 10-fluoro-, hydrochloride is 3833-87-2.
What is the molecular formula of Aporphine, 10-fluoro-, hydrochloride?
The molecular formula of Aporphine, 10-fluoro-, hydrochloride is C17H17ClFN.
What is the molecular weight of Aporphine, 10-fluoro-, hydrochloride?
The molecular weight of Aporphine, 10-fluoro-, hydrochloride is 289.10 g/mol.
Where can I buy Aporphine, 10-fluoro-, hydrochloride?
You can request a quote for Aporphine, 10-fluoro-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aporphine, 10-fluoro-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Aporphine, 10-fluoro-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.