3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one
TL;DR: 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one (CAS 15347-83-8) is a chemical compound with molecular formula C6H7Cl3O2 and molecular weight 215.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-4-(trichloromethyl)oxetan-2-one
Also Known As: 3,3-dimethyl-4-(trichloromethyl)oxetan-2-one, 3,3-Dimethyl-4-(trichloromethyl)-2-oxetanone, 2-Oxetanone, 3,3-dimethyl-4-(trichloromethyl)-, 3,3-dimethyl-4-trichloromethyl-oxetan-2-one, 3-HYDROXY-2,2-DIMETHYL-4,4,4-TRICHLOROBUTYRIC ACID BETA-LACTONE
| Molecular Formula | C6H7Cl3O2 |
|---|---|
| Molecular Weight | 215.95 g/mol |
| LogP | 2.3082 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.95116 |
| Heavy Atoms | 11 |
| Complexity | 194.49431 |
Chemical Identifiers
| CAS Number | 15347-83-8 |
|---|---|
| SMILES | CC1(C(OC1=O)C(Cl)(Cl)Cl)C |
Product Overview
3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one (CAS 15347-83-8), with molecular formula C6H7Cl3O2 and molecular weight 215.95 g/mol. IUPAC: 3,3-dimethyl-4-(trichloromethyl)oxetan-2-one.
Chemical Property Profile of 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one
Property Insights of 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one
The XLogP value of 2.3082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-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 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one?
The CAS number of 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one is 15347-83-8.
What is the molecular formula of 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one?
The molecular formula of 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one is C6H7Cl3O2.
What is the molecular weight of 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one?
The molecular weight of 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one is 215.95 g/mol.
Where can I buy 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one?
You can request a quote for 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-4-(trichloromethyl)oxetan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.