4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)
TL;DR: 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) (CAS 64038-68-2) is a chemical compound with molecular formula C6H10F6N2O and molecular weight 240.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2,2-bis(trifluoromethyl)imidazolidine;hydrate
Also Known As: 2,2-Bis(trifluoromethyl)-4-methylimidazolidine hydrate, IMIDAZOLIDINE, 2,2-BIS(TRIFLUOROMETHYL)-4-METHYL-, HYDRATE, 4-methyl-2,2-bis(trifluoromethyl)imidazolidine hydrate, 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1), Imidazolidine, 4-methyl-2,2-bis(trifluoromethyl)-, monohydrate
| Molecular Formula | C6H10F6N2O |
|---|---|
| Molecular Weight | 240.07 g/mol |
| LogP | 0.56 |
| Topological Polar Surface Area | 25.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.06973 |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 64038-68-2 |
|---|---|
| SMILES | CC1CNC(N1)(C(F)(F)F)C(F)(F)F.O |
| InChIKey | KBLOTQMFQLJJPR-UHFFFAOYSA-N |
Product Overview
4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) (CAS 64038-68-2), with molecular formula C6H10F6N2O and molecular weight 240.07 g/mol. IUPAC: 4-methyl-2,2-bis(trifluoromethyl)imidazolidine;hydrate.
Chemical Property Profile of 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)
Property Insights of 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)
The XLogP value of 0.56 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1). With a topological polar surface area (TPSA) of 25.1 Ų, 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) has 3 hydrogen bond donor(s) and 9 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 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)?
The CAS number of 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) is 64038-68-2.
What is the molecular formula of 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)?
The molecular formula of 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) is C6H10F6N2O.
What is the molecular weight of 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)?
The molecular weight of 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) is 240.07 g/mol.
Where can I buy 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)?
You can request a quote for 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2,2-bis(trifluoromethyl)imidazolidine--water (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.