![3-碘三环[3.3.1.13,7]癸烷-1-甲酸 structure](/static/products/4271/42711-77-3.webp)
3-碘三环[3.3.1.13,7]癸烷-1-甲酸
TL;DR: 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 (CAS 42711-77-3) is a chemical compound with molecular formula C11H15IO2 and molecular weight 306.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-碘三环[3.3.1.13,7]癸烷-1-甲酸
3-iodoadamantane-1-carboxylic acid
Also Known As: 3-iodoadamantane-1-carboxylic acid, 1-Iodo-3-adamantanecarboxylic acid, 3-iodo-1-adamantanecarboxylic acid, 3-ADAMANTANECARBOXYLIC ACID, 1-IODO-, Tricyclo[3.3.1.13,7]decane-1-carboxylicacid, 3-iodo-
| Molecular Formula | C11H15IO2 |
|---|---|
| Molecular Weight | 306.01 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.0117 |
| Heavy Atoms | 14 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 42711-77-3 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)I)C(=O)O |
| InChIKey | VMCNPOBDWYHJAP-UHFFFAOYSA-N |
Product Overview
3-碘三环[3.3.1.13,7]癸烷-1-甲酸 (CAS 42711-77-3), with molecular formula C11H15IO2 and molecular weight 306.01 g/mol. IUPAC: 3-iodoadamantane-1-carboxylic acid.
Chemical Property Profile of 3-碘三环[3.3.1.13,7]癸烷-1-甲酸
Property Insights of 3-碘三环[3.3.1.13,7]癸烷-1-甲酸
The XLogP value of 3.0 indicates that 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 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 3-碘三环[3.3.1.13,7]癸烷-1-甲酸?
The CAS number of 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 is 42711-77-3.
What is the molecular formula of 3-碘三环[3.3.1.13,7]癸烷-1-甲酸?
The molecular formula of 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 is C11H15IO2.
What is the molecular weight of 3-碘三环[3.3.1.13,7]癸烷-1-甲酸?
The molecular weight of 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 is 306.01 g/mol.
Where can I buy 3-碘三环[3.3.1.13,7]癸烷-1-甲酸?
You can request a quote for 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-碘三环[3.3.1.13,7]癸烷-1-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3-碘三环[3.3.1.13,7]癸烷-1-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.