杨梅醇
TL;DR: 杨梅醇 (CAS 33606-81-4) is a chemical compound with molecular formula C4H5F3N2 and molecular weight 138.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
杨梅醇
2-(trifluoromethyl)-4,5-dihydro-1H-imidazole
Also Known As: 2-(trifluoromethyl)-4,5-dihydro-1H-imidazole, Bis[2-(2-chloroethoxy)ethyl]ether, 1H-Imidazole, 4,5-dihydro-2-(trifluoromethyl)-, 1H-Imidazole,4,5-dihydro-2-(trifluoromethyl)-, 2-(trifluormethyl)-4,5-dihydro-1H-imidazol
| Molecular Formula | C4H5F3N2 |
|---|---|
| Molecular Weight | 138.04 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.04048 |
| Heavy Atoms | 9 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 33606-81-4 |
|---|---|
| SMILES | C1CN=C(N1)C(F)(F)F |
| InChIKey | AJVDOFRZQWMSLK-UHFFFAOYSA-N |
Product Overview
杨梅醇 (CAS 33606-81-4), with molecular formula C4H5F3N2 and molecular weight 138.04 g/mol. IUPAC: 2-(trifluoromethyl)-4,5-dihydro-1H-imidazole.
Chemical Property Profile of 杨梅醇
Property Insights of 杨梅醇
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 杨梅醇. With a topological polar surface area (TPSA) of 24.4 Ų, 杨梅醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 杨梅醇 has 1 hydrogen bond donor(s) and 4 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 杨梅醇?
The CAS number of 杨梅醇 is 33606-81-4.
What is the molecular formula of 杨梅醇?
The molecular formula of 杨梅醇 is C4H5F3N2.
What is the molecular weight of 杨梅醇?
The molecular weight of 杨梅醇 is 138.04 g/mol.
Where can I buy 杨梅醇?
You can request a quote for 杨梅醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 杨梅醇?
Yes, KEHONG BIO provides custom synthesis services for 杨梅醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.