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8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
TL;DR: 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one (CAS 313471-07-7) is a chemical compound with molecular formula C13H11ClO3 and molecular weight 250.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-7-methoxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
Also Known As: IFLab1_001611, EiM07-13830, 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one, 8-Chloro-7-methoxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one, 12-chloro-11-methoxy-8-oxatricyclo[7.4.0.0^{2,6}]trideca-1(9),2(6),10,12-tetraen-7-one
| Molecular Formula | C13H11ClO3 |
|---|---|
| Molecular Weight | 250.04 g/mol |
| LogP | 2.9437 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.03967 |
| Heavy Atoms | 17 |
| Complexity | 657.7427 |
Chemical Identifiers
| CAS Number | 313471-07-7 |
|---|---|
| SMILES | COC1=C(C=C2C3=C(CCC3)C(=O)OC2=C1)Cl |
Product Overview
8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one (CAS 313471-07-7), with molecular formula C13H11ClO3 and molecular weight 250.04 g/mol. IUPAC: 8-chloro-7-methoxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one.
Chemical Property Profile of 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Property Insights of 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
The XLogP value of 2.9437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one. With a topological polar surface area (TPSA) of 39.44 Ų, 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one 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-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
The CAS number of 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one is 313471-07-7.
What is the molecular formula of 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
The molecular formula of 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one is C13H11ClO3.
What is the molecular weight of 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
The molecular weight of 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one is 250.04 g/mol.
Where can I buy 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
You can request a quote for 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 8-chloro-7-methoxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.