![1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone structure](/static/products/6953/6953-31-7.webp)
1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone
TL;DR: 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone (CAS 6953-31-7) is a chemical compound with molecular formula C17H10Cl6O2 and molecular weight 455.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[(2-acetyl-3,5,6-trichlorophenyl)methyl]-3,4,6-trichlorophenyl]ethanone
Also Known As: KST-1B7684, 1,1'-[methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone, 1-[2-[(2-acetyl-3,5,6-trichlorophenyl)methyl]-3,4,6-trichlor, 1-[2-[(2-acetyl-3,5,6-trichlorophenyl)methyl]-3,4,6-trichlorophenyl]ethanone, 1,1'-[Methylenebis(3,4,6-trichloro-2,1-phenylene)]di(ethan-1-one)
| Molecular Formula | C17H10Cl6O2 |
|---|---|
| Molecular Weight | 455.88 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.8812 |
| Heavy Atoms | 25 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 6953-31-7 |
|---|---|
| SMILES | CC(=O)C1=C(C(=C(C=C1Cl)Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)C(=O)C |
| InChIKey | JRIITRINHKMUNT-UHFFFAOYSA-N |
Product Overview
1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone (CAS 6953-31-7), with molecular formula C17H10Cl6O2 and molecular weight 455.88 g/mol. IUPAC: 1-[2-[(2-acetyl-3,5,6-trichlorophenyl)methyl]-3,4,6-trichlorophenyl]ethanone.
Chemical Property Profile of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone
Property Insights of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone
The XLogP value of 7.0 indicates that 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone?
The CAS number of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone is 6953-31-7.
What is the molecular formula of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone?
The molecular formula of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone is C17H10Cl6O2.
What is the molecular weight of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone?
The molecular weight of 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone is 455.88 g/mol.
Where can I buy 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone?
You can request a quote for 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-[Methanediylbis(3,4,6-trichlorobenzene-2,1-diyl)]diethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.