5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene
TL;DR: 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene (CAS 69975-68-4) is a chemical compound with molecular formula C10H13I and molecular weight 260.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-iodotricyclo[5.2.1.02,6]dec-3-ene
Also Known As: 5-iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene, 4,7-Methano-1H-indene,3a,4,5,6,7,7a-hexahydro-5-iodo, 4,7-Methano-1H-indene, 3a,4,5,6,7,7a-hexahydro-5-iodo-
| Molecular Formula | C10H13I |
|---|---|
| Molecular Weight | 260.01 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.0062 |
| Heavy Atoms | 11 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 69975-68-4 |
|---|---|
| SMILES | C1C=CC2C1C3CC2C(C3)I |
| InChIKey | CHAPJYVONOIHHP-UHFFFAOYSA-N |
Product Overview
5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene (CAS 69975-68-4), with molecular formula C10H13I and molecular weight 260.01 g/mol. IUPAC: 9-iodotricyclo[5.2.1.02,6]dec-3-ene.
Chemical Property Profile of 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene
Property Insights of 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene
The XLogP value of 3.6 indicates that 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene has 0 hydrogen bond donor(s) and 0 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-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene?
The CAS number of 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene is 69975-68-4.
What is the molecular formula of 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene?
The molecular formula of 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene is C10H13I.
What is the molecular weight of 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene?
The molecular weight of 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene is 260.01 g/mol.
Where can I buy 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene?
You can request a quote for 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene?
Yes, KEHONG BIO provides custom synthesis services for 5-Iodo-3a,4,5,6,7,7a-hexahydro-1h-4,7-methanoindene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.