Benzoylnorecgonine hydrochloride
TL;DR: Benzoylnorecgonine hydrochloride (CAS 60426-41-7) is a chemical compound with molecular formula C15H18ClNO4 and molecular weight 311.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R)-3-benzoyloxy-8-azabicyclo[3.2.1]octane-2-carboxylic acid;hydrochloride
Also Known As: Benzoylnorecgonine hydrochloride, Benzoyl Norecgonine Hydrochloride, (1R)-3-benzoyloxy-8-azabicyclo[3.2.1]octane-2-carboxylic acid;hydrochloride, 8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-(benzoyloxy)-, hydrochloride, (1R-(exo,exo))-, (1R)-3-(Benzoyloxy)-8-azabicyclo[3.2.1]octane-2-carboxylic acid--hydrogen chloride (1/1)
| Molecular Formula | C15H18ClNO4 |
|---|---|
| Molecular Weight | 311.09 g/mol |
| LogP | 1.8589 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.09244 |
| Heavy Atoms | 21 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 60426-41-7 |
|---|---|
| SMILES | C1CC2CC(C([C@@H]1N2)C(=O)O)OC(=O)C3=CC=CC=C3.Cl |
| InChIKey | SNVXULYEWYGPGU-FFZUUTFOSA-N |
Product Overview
Benzoylnorecgonine hydrochloride (CAS 60426-41-7), with molecular formula C15H18ClNO4 and molecular weight 311.09 g/mol. IUPAC: (1R)-3-benzoyloxy-8-azabicyclo[3.2.1]octane-2-carboxylic acid;hydrochloride.
Chemical Property Profile of Benzoylnorecgonine hydrochloride
Property Insights of Benzoylnorecgonine hydrochloride
The XLogP value of 1.8589 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoylnorecgonine hydrochloride. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoylnorecgonine hydrochloride. Following Lipinski's Rule of Five, Benzoylnorecgonine hydrochloride has 3 hydrogen bond donor(s) and 5 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 Benzoylnorecgonine hydrochloride?
The CAS number of Benzoylnorecgonine hydrochloride is 60426-41-7.
What is the molecular formula of Benzoylnorecgonine hydrochloride?
The molecular formula of Benzoylnorecgonine hydrochloride is C15H18ClNO4.
What is the molecular weight of Benzoylnorecgonine hydrochloride?
The molecular weight of Benzoylnorecgonine hydrochloride is 311.09 g/mol.
Where can I buy Benzoylnorecgonine hydrochloride?
You can request a quote for Benzoylnorecgonine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoylnorecgonine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoylnorecgonine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.