![2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one structure](/static/products/7850/78502-05-3.webp)
2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one
TL;DR: 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one (CAS 78502-05-3) is a chemical compound with molecular formula C12H13ClOS and molecular weight 240.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chlorospiro[5H-cyclopenta[b]thiophene-6,1'-cyclohexane]-4-one
Also Known As: 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one, AP-836/41220432, 2-chlorospiro[5H-cyclopenta[b]thiophene-6,1'-cyclohexane]-4-one, 2'-Chlorospiro[cyclohexane-1,6'-cyclopenta[b]thiophen]-4'(5'H)-one, 2-chlorospiro[5,6-dihydrocyclopenta[1,2-b]thiophene-6,1'-cyclohexane]-4-one
| Molecular Formula | C12H13ClOS |
|---|---|
| Molecular Weight | 240.04 g/mol |
| LogP | 4.1898 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.03757 |
| Heavy Atoms | 15 |
| Complexity | 415.25665 |
Chemical Identifiers
| CAS Number | 78502-05-3 |
|---|---|
| SMILES | C1CCC2(CC1)CC(=O)C3=C2SC(=C3)Cl |
Product Overview
2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one (CAS 78502-05-3), with molecular formula C12H13ClOS and molecular weight 240.04 g/mol. IUPAC: 2-chlorospiro[5H-cyclopenta[b]thiophene-6,1'-cyclohexane]-4-one.
Chemical Property Profile of 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one
Property Insights of 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one
The XLogP value of 4.1898 indicates that 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one has 0 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 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one?
The CAS number of 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one is 78502-05-3.
What is the molecular formula of 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one?
The molecular formula of 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one is C12H13ClOS.
What is the molecular weight of 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one?
The molecular weight of 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one is 240.04 g/mol.
Where can I buy 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one?
You can request a quote for 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-5,6-dihydrospiro(4H-cyclopenta[b]thiophene-6,1'-cyclohexane)-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.