(1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid
TL;DR: (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid (CAS 46365-22-4) is a chemical compound with molecular formula C10H16O4S and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonic acid
Also Known As: EINECS 256-266-5, (1R)-2-oxo-bornane-3endo-sulfonic acid, (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid, -4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulphonicacid, 4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid
| Molecular Formula | C10H16O4S |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 1.268 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.07693 |
| Heavy Atoms | 15 |
| Complexity | 422.70334 |
Chemical Identifiers
| CAS Number | 46365-22-4 |
|---|---|
| SMILES | CC1([C@@H]2CCC1(C(=O)C2S(=O)(=O)O)C)C |
Product Overview
(1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid (CAS 46365-22-4), with molecular formula C10H16O4S and molecular weight 232.08 g/mol. IUPAC: (1S)-4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonic acid.
Chemical Property Profile of (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid
Property Insights of (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid
The XLogP value of 1.268 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid. Following Lipinski's Rule of Five, (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid has 1 hydrogen bond donor(s) and 3 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 (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid?
The CAS number of (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid is 46365-22-4.
What is the molecular formula of (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid?
The molecular formula of (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid is C10H16O4S.
What is the molecular weight of (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid?
The molecular weight of (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid is 232.08 g/mol.
Where can I buy (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid?
You can request a quote for (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for (1S-endo)-4,7,7-Trimethyl-3-oxobicyclo(2.2.1)heptane-2-sulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.