(3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid
TL;DR: (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid (CAS 60844-32-8) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid
Also Known As: (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid, rel-(3aR,7aR)-2,3,3a,4,7,7a-Hexahydro-1H-indene-2-carboxylic acid
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.0634 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 203.87846 |
Chemical Identifiers
| CAS Number | 60844-32-8 |
|---|---|
| SMILES | C1C=CC[C@H]2[C@H]1CC(C2)C(=O)O |
Product Overview
(3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid (CAS 60844-32-8), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid.
Chemical Property Profile of (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid
Property Insights of (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid
The XLogP value of 2.0634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid 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 (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid?
The CAS number of (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid is 60844-32-8.
What is the molecular formula of (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid?
The molecular formula of (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid is C10H14O2.
What is the molecular weight of (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid?
The molecular weight of (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid is 166.10 g/mol.
Where can I buy (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid?
You can request a quote for (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (3aR,7aR)-2,3,3a,4,7,7a-hexahydro-1H-indene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.