![2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one structure](/static/products/7316/7316-61-2.webp)
2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one
TL;DR: 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one (CAS 7316-61-2) is a chemical compound with molecular formula C11H8Cl2O and molecular weight 226.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-7,7a-dihydro-2aH-cyclobuta[a]inden-1-one
Also Known As: 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one, 2,2-dichloro-7,7a-dihydro-2aH-cyclobuta[a]inden-1-one, 2,2-DICHLORO-1H,2H,2AH,7H,7AH-CYCLOBUTA[A]INDEN-1-ONE, 2,2-dichloro-2aH,7H,7aH-cyclobuta[a]inden-1-one, 2,2-Dichloro-2,2a,7,7a-tetrahydro-1H-cyclobut[a]inden-1-one
| Molecular Formula | C11H8Cl2O |
|---|---|
| Molecular Weight | 226.00 g/mol |
| LogP | 2.6991 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 225.99522 |
| Heavy Atoms | 14 |
| Complexity | 425.05063 |
Chemical Identifiers
| CAS Number | 7316-61-2 |
|---|---|
| SMILES | C1C2C(C3=CC=CC=C31)C(C2=O)(Cl)Cl |
Product Overview
2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one (CAS 7316-61-2), with molecular formula C11H8Cl2O and molecular weight 226.00 g/mol. IUPAC: 2,2-dichloro-7,7a-dihydro-2aH-cyclobuta[a]inden-1-one.
Chemical Property Profile of 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one
Property Insights of 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one
The XLogP value of 2.6991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one. With a topological polar surface area (TPSA) of 17.07 Ų, 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one has 0 hydrogen bond donor(s) and 1 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 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one?
The CAS number of 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one is 7316-61-2.
What is the molecular formula of 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one?
The molecular formula of 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one is C11H8Cl2O.
What is the molecular weight of 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one?
The molecular weight of 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one is 226.00 g/mol.
Where can I buy 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one?
You can request a quote for 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2,2-dichloro-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.