TL;DR: 4-Azido-2,3,5,6-tetrafluorobenzyl amine hydrochloride (CAS 139428-47-0) is a chemical compound with molecular formula C7H5ClF4N4 and molecular weight 256.0139 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-azido-2,3,5,6-tetrafluorophenyl)methanamine;hydrochloride
Also Known As: 4-AZIDO-2,3,5,6-TETRAFLUOROBENZYL AMINE HYDROCHLORIDE, (4-azido-2,3,5,6-tetrafluorophenyl)methanamine;hydrochloride, 4-Azido-2,3,5,6-tetrafluorobenzylamine hydrochloride, I14-39597, (4-azido-2,3,5,6-tetrafluoro-phenyl)methanamine Hydrochloride
| Molecular Formula | C7H5ClF4N4 |
| Molecular Weight | 256.0139 g/mol |
| XLogP | 3.0653 |
| Topological Polar Surface Area (TPSA) | 40.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.0139 Da |
| Heavy Atoms | 16 |
| Complexity | 254.0 |
| SMILES | C(C1=C(C(=C(C(=C1F)F)N=[N+]=[N-])F)F)N.Cl |
| InChIKey | VAPCAPYEWOSREQ-UHFFFAOYSA-N |
The XLogP value of 3.0653 indicates that 4-Azido-2,3,5,6-tetrafluorobenzyl amine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.4 Ų, 4-Azido-2,3,5,6-tetrafluorobenzyl amine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Azido-2,3,5,6-tetrafluorobenzyl amine hydrochloride has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Azido-2,3,5,6-tetrafluorobenzyl amine hydrochloride is 139428-47-0.
The molecular formula of 4-Azido-2,3,5,6-tetrafluorobenzyl amine hydrochloride is C7H5ClF4N4.
The molecular weight of 4-Azido-2,3,5,6-tetrafluorobenzyl amine hydrochloride is 256.0139 g/mol.
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