8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate
TL;DR: 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate (CAS 7239-51-2) is a chemical compound with molecular formula C17H21ClO3S and molecular weight 340.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10-chloro-8-tricyclo[4.3.1.01,6]decanyl) 4-methylbenzenesulfonate
Also Known As: 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate
| Molecular Formula | C17H21ClO3S |
|---|---|
| Molecular Weight | 340.09 g/mol |
| LogP | 4.03052 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.09 |
| Heavy Atoms | 22 |
| Complexity | 677.11914 |
Chemical Identifiers
| CAS Number | 7239-51-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2CC34CCCCC3(C2)C4Cl |
Product Overview
8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate (CAS 7239-51-2), with molecular formula C17H21ClO3S and molecular weight 340.09 g/mol. IUPAC: (10-chloro-8-tricyclo[4.3.1.01,6]decanyl) 4-methylbenzenesulfonate.
Chemical Property Profile of 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate
Property Insights of 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate
The XLogP value of 4.03052 indicates that 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate has 0 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 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate?
The CAS number of 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate is 7239-51-2.
What is the molecular formula of 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate?
The molecular formula of 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate is C17H21ClO3S.
What is the molecular weight of 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate?
The molecular weight of 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate is 340.09 g/mol.
Where can I buy 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate?
You can request a quote for 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 8-Chlorohexahydro-1H-3a,7a-methanoinden-2-yl 4-methylbenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.