TL;DR: RefChem:331767 (CAS 145430-05-3) is a chemical compound with molecular formula C23H18F6NO3P and molecular weight 501.09283 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
Also Known As: Carbamic acid, (1-(diphenylphosphinyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl)-, phenylmethyl ester, benzyl N-(2-diphenylphosphoryl-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate, Benzyl (2-(diphenylphosphoryl)-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate, BENZYL N-(2-DIPHENYLPHOSPHORYL-1,1,1,3,3,3-HEXAFLUORO-PROPAN-2-YL)CARB AMATE, Carbamic acid,[1-(diphenylphosphinyl)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-,phenylmethyl ester (9CI)
| Molecular Formula | C23H18F6NO3P |
| Molecular Weight | 501.09283 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 501.09283 Da |
| Heavy Atoms | 34 |
| Complexity | 687.0 |
| SMILES | C1=CC=C(C=C1)COC(=O)NC(C(F)(F)F)(C(F)(F)F)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | GZYRPVGTNHFDCN-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that RefChem:331767 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, RefChem:331767 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:331767 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:331767 is 145430-05-3.
The molecular formula of RefChem:331767 is C23H18F6NO3P.
The molecular weight of RefChem:331767 is 501.09283 g/mol.
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