3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride
TL;DR: 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride (CAS 1220-31-1) is a chemical compound with molecular formula C17H28Cl2N2 and molecular weight 330.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(1,8,8-trimethyl-3-azoniabicyclo[3.2.1]octan-3-yl)methyl]phenyl]azanium dichloride
Also Known As: 3-(p-Aminobenzyl)-1,8,8-trimethyl-3-azabicyclo(3.2.1)octane dihydrochloride, 3-AZABICYCLO(3.2.1)OCTANE, 3-(p-AMINOBENZYL)-1,8,8-TRIMETHYL-, DIHYDROCHLORIDE, [4-[(1,8,8-Trimethyl-3-azoniabicyclo[3.2.1]octan-3-yl)methyl]phenyl]azaniumdichloride, [4-[(5,8,8-trimethyl-3-azoniabicyclo[3.2.1]octan-3-yl)methyl]phenyl]azanium, [4-[(5,8,8-trimethyl-3-azoniabicyclo[3.2.1]octan-3-yl)methyl]phenyl]azanium dichloride
| Molecular Formula | C17H28Cl2N2 |
|---|---|
| Molecular Weight | 330.16 g/mol |
| LogP | -4.59 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.16296 |
| Heavy Atoms | 21 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 1220-31-1 |
|---|---|
| SMILES | CC1(C2CCC1(C[NH+](C2)CC3=CC=C(C=C3)[NH3+])C)C.[Cl-].[Cl-] |
| InChIKey | JXFXQBRHCQGLBM-UHFFFAOYSA-N |
Product Overview
3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride (CAS 1220-31-1), with molecular formula C17H28Cl2N2 and molecular weight 330.16 g/mol. IUPAC: [4-[(1,8,8-trimethyl-3-azoniabicyclo[3.2.1]octan-3-yl)methyl]phenyl]azanium dichloride.
Chemical Property Profile of 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride
Property Insights of 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride
The XLogP value of -4.59 indicates that 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.1 Ų, 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride has 2 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 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride?
The CAS number of 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride is 1220-31-1.
What is the molecular formula of 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride?
The molecular formula of 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride is C17H28Cl2N2.
What is the molecular weight of 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride?
The molecular weight of 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride is 330.16 g/mol.
Where can I buy 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride?
You can request a quote for 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.