7betaH-Retronecanol
TL;DR: 7betaH-Retronecanol (CAS 6029-74-9) is a chemical compound with molecular formula C8H15NO and molecular weight 141.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,7S,8R)-7-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ol
Also Known As: 7bH-Retronecanol, 7betaH-Retronecanol, 1H-Pyrrolizin-1-ol, hexahydro-7-methyl-, (1S-(1alpha,7beta,7aalpha))-, (1S,7S,8R)-7-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ol
| Molecular Formula | C8H15NO |
|---|---|
| Molecular Weight | 141.12 g/mol |
| LogP | 0.4614 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.11537 |
| Heavy Atoms | 10 |
| Complexity | 123.219284 |
Chemical Identifiers
| CAS Number | 6029-74-9 |
|---|---|
| SMILES | C[C@H]1CCN2[C@H]1[C@H](CC2)O |
Product Overview
7betaH-Retronecanol (CAS 6029-74-9), with molecular formula C8H15NO and molecular weight 141.12 g/mol. IUPAC: (1S,7S,8R)-7-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ol.
Chemical Property Profile of 7betaH-Retronecanol
Property Insights of 7betaH-Retronecanol
The XLogP value of 0.4614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7betaH-Retronecanol. With a topological polar surface area (TPSA) of 23.47 Ų, 7betaH-Retronecanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7betaH-Retronecanol 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 7betaH-Retronecanol?
The CAS number of 7betaH-Retronecanol is 6029-74-9.
What is the molecular formula of 7betaH-Retronecanol?
The molecular formula of 7betaH-Retronecanol is C8H15NO.
What is the molecular weight of 7betaH-Retronecanol?
The molecular weight of 7betaH-Retronecanol is 141.12 g/mol.
Where can I buy 7betaH-Retronecanol?
You can request a quote for 7betaH-Retronecanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7betaH-Retronecanol?
Yes, KEHONG BIO provides custom synthesis services for 7betaH-Retronecanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.