![dichloromethylene[?]one structure](/static/products/1311/13114-89-1.webp)
dichloromethylene[?]one
TL;DR: dichloromethylene[?]one (CAS 13114-89-1) is a chemical compound with molecular formula C19H12Cl2O2 and molecular weight 342.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
18-(dichloromethylidene)-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-16-one
Also Known As: dichloromethylene[?]one, 9,10-Dihydro-9,10-ethanoanthracen-11-carbonsaeure-12--gamma-lact, 18-(Dichloromethylidene)-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-16-one, 18-(dichloromethylidene)-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-16-one(non-preferred name)
| Molecular Formula | C19H12Cl2O2 |
|---|---|
| Molecular Weight | 342.02 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 342.02142 |
| Heavy Atoms | 23 |
| Complexity | 544.0 |
Chemical Identifiers
| CAS Number | 13114-89-1 |
|---|---|
| SMILES | C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=C(Cl)Cl)OC4=O |
| InChIKey | YLUVPNMIHGZZMH-UHFFFAOYSA-N |
Product Overview
dichloromethylene[?]one (CAS 13114-89-1), with molecular formula C19H12Cl2O2 and molecular weight 342.02 g/mol. IUPAC: 18-(dichloromethylidene)-17-oxapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-16-one.
Chemical Property Profile of dichloromethylene[?]one
Property Insights of dichloromethylene[?]one
The XLogP value of 4.5 indicates that dichloromethylene[?]one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, dichloromethylene[?]one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, dichloromethylene[?]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 dichloromethylene[?]one?
The CAS number of dichloromethylene[?]one is 13114-89-1.
What is the molecular formula of dichloromethylene[?]one?
The molecular formula of dichloromethylene[?]one is C19H12Cl2O2.
What is the molecular weight of dichloromethylene[?]one?
The molecular weight of dichloromethylene[?]one is 342.02 g/mol.
Where can I buy dichloromethylene[?]one?
You can request a quote for dichloromethylene[?]one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dichloromethylene[?]one?
Yes, KEHONG BIO provides custom synthesis services for dichloromethylene[?]one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.