3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate
TL;DR: 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate (CAS 5331-67-9) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-tricyclo[5.2.1.02,6]dec-4-enyl formate
Also Known As: tricyclo[5.2.1.02,6]dec-4-en-8-yl formate, (3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-indene)-5-yl=formate, 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 1.7601 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 258.8159 |
Chemical Identifiers
| CAS Number | 5331-67-9 |
|---|---|
| SMILES | C1C=CC2C1C3CC2C(C3)OC=O |
Product Overview
3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate (CAS 5331-67-9), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: 8-tricyclo[5.2.1.02,6]dec-4-enyl formate.
Chemical Property Profile of 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate
Property Insights of 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate
The XLogP value of 1.7601 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate. With a topological polar surface area (TPSA) of 26.3 Ų, 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate has 0 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 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate?
The CAS number of 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate is 5331-67-9.
What is the molecular formula of 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate?
The molecular formula of 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate is C11H14O2.
What is the molecular weight of 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate?
The molecular weight of 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate is 178.10 g/mol.
Where can I buy 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate?
You can request a quote for 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate?
Yes, KEHONG BIO provides custom synthesis services for 3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-5-ol, Formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.