6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE
TL;DR: 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE (CAS 22194-33-8) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) benzoate
Also Known As: 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE, (6-methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) benzoate, 6-Methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl benzoate
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 22194-33-8 |
|---|---|
| SMILES | CN1C2CC(CC1C(C2)OC)OC(=O)C3=CC=CC=C3 |
| InChIKey | ZRVCPWWUTDVVKH-UHFFFAOYSA-N |
Product Overview
6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE (CAS 22194-33-8), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: (6-methoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) benzoate.
Chemical Property Profile of 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE
Property Insights of 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE. With a topological polar surface area (TPSA) of 38.8 Ų, 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE has 0 hydrogen bond donor(s) and 4 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 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE?
The CAS number of 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE is 22194-33-8.
What is the molecular formula of 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE?
The molecular formula of 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE is C16H21NO3.
What is the molecular weight of 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE?
The molecular weight of 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE is 275.15 g/mol.
Where can I buy 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE?
You can request a quote for 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE?
Yes, KEHONG BIO provides custom synthesis services for 6-METHOXY TROPINE BENZOIC ACID ESTER HYDROCHLORIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.