RefChem:229930
TL;DR: RefChem:229930 (CAS 106036-82-2) is a chemical compound with molecular formula C7H12ClF6N3 and molecular weight 287.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-2-[2-methyl-3,3-bis(trifluoromethyl)diaziridin-1-yl]ethanamine;hydrochloride
Also Known As: 1-beta-Dimethylaminoethyl-3,3-bis(trifluoromethyl)diaziridine hydrochloride, N,N-Dimethyl-3,3-bis(trifluoromethyl)-1-diaziridineethanamine monohydrochloride, 1-Diaziridineethanamine, N,N-dimethyl-3,3-bis(trifluoromethyl)-, monohydrochloride, 1-Diaziridineethanamine, N,2-dimethyl-3,3-bis(trifluoromethyl)-, hydrochloride (1:1), N-methyl-2-[2-methyl-3,3-bis(trifluoromethyl)diaziridin-1-yl]ethanamine hydrochloride
| Molecular Formula | C7H12ClF6N3 |
|---|---|
| Molecular Weight | 287.06 g/mol |
| LogP | 1.6109 |
| Topological Polar Surface Area | 18.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.0624 |
| Heavy Atoms | 17 |
| Complexity | 251.3151 |
Chemical Identifiers
| CAS Number | 106036-82-2 |
|---|---|
| SMILES | CNCCN1C(N1C)(C(F)(F)F)C(F)(F)F.Cl |
Product Overview
RefChem:229930 (CAS 106036-82-2), with molecular formula C7H12ClF6N3 and molecular weight 287.06 g/mol. IUPAC: N-methyl-2-[2-methyl-3,3-bis(trifluoromethyl)diaziridin-1-yl]ethanamine;hydrochloride.
Chemical Property Profile of RefChem:229930
Property Insights of RefChem:229930
The XLogP value of 1.6109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:229930. With a topological polar surface area (TPSA) of 18.05 Ų, RefChem:229930 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:229930 has 1 hydrogen bond donor(s) and 3 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 RefChem:229930?
The CAS number of RefChem:229930 is 106036-82-2.
What is the molecular formula of RefChem:229930?
The molecular formula of RefChem:229930 is C7H12ClF6N3.
What is the molecular weight of RefChem:229930?
The molecular weight of RefChem:229930 is 287.06 g/mol.
Where can I buy RefChem:229930?
You can request a quote for RefChem:229930 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:229930?
Yes, KEHONG BIO provides custom synthesis services for RefChem:229930 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.