5-Bromoperhydroisoquinoline hydrobromide
TL;DR: 5-Bromoperhydroisoquinoline hydrobromide (CAS 90435-92-0) is a chemical compound with molecular formula C9H17Br2N and molecular weight 296.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline;hydrobromide
Also Known As: 5-bromoperhydroisoquinoline hydrobromide, 5-bromodecahydroisoquinoline hydrobromide, 5-bromodecahydroisoquinolinehydrobromide, 5-bromo-decahydroisoquinoline hydrobromide, 5-bromo-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline;hydrobromide
| Molecular Formula | C9H17Br2N |
|---|---|
| Molecular Weight | 296.97 g/mol |
| LogP | 2.7374 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 296.97278 |
| Heavy Atoms | 12 |
| Complexity | 138.49022 |
Chemical Identifiers
| CAS Number | 90435-92-0 |
|---|---|
| SMILES | C1CC2CNCCC2C(C1)Br.Br |
Product Overview
5-Bromoperhydroisoquinoline hydrobromide (CAS 90435-92-0), with molecular formula C9H17Br2N and molecular weight 296.97 g/mol. IUPAC: 5-bromo-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline;hydrobromide.
Chemical Property Profile of 5-Bromoperhydroisoquinoline hydrobromide
Property Insights of 5-Bromoperhydroisoquinoline hydrobromide
The XLogP value of 2.7374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromoperhydroisoquinoline hydrobromide. With a topological polar surface area (TPSA) of 12.03 Ų, 5-Bromoperhydroisoquinoline hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromoperhydroisoquinoline hydrobromide 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 5-Bromoperhydroisoquinoline hydrobromide?
The CAS number of 5-Bromoperhydroisoquinoline hydrobromide is 90435-92-0.
What is the molecular formula of 5-Bromoperhydroisoquinoline hydrobromide?
The molecular formula of 5-Bromoperhydroisoquinoline hydrobromide is C9H17Br2N.
What is the molecular weight of 5-Bromoperhydroisoquinoline hydrobromide?
The molecular weight of 5-Bromoperhydroisoquinoline hydrobromide is 296.97 g/mol.
Where can I buy 5-Bromoperhydroisoquinoline hydrobromide?
You can request a quote for 5-Bromoperhydroisoquinoline hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromoperhydroisoquinoline hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromoperhydroisoquinoline hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.