TL;DR: 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite (CAS 20227-53-6) is a chemical compound with molecular formula C53H77O4P and molecular weight 808.55597 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-tert-butyl-4-[2-(3-tert-butyl-4-hydroxyphenyl)propan-2-yl]phenyl] bis(4-nonylphenyl) phosphite
Also Known As: Phosphorous acid, 2-(1,1-dimethylethyl)-4-[1-[3-(1,1-dimethylethyl)-4-hydroxyphenyl]-1-methylethyl]phenyl bis(4-nonylphenyl) ester, 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite, Phosphorous acid, 2-(1,1-dimethylethyl)-4-(1-(3-(1,1-dimethylethyl)-4-hydroxyphenyl)-1-methylethyl)phenyl bis(4-nonylphenyl) ester, 2-(tert-butyl)-4-[1-[3-(tert-butyl)-4-hydroxyphenyl]-1-methylethyl]phenyl bis(4-nonylphenyl)phosphite, 2-(tert-Butyl)-4-(1-(3-(tert-butyl)-4-hydroxyphenyl)-1-methylethyl)phenyl bis(4-nonylphenyl) phosphite
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C53H77O4P |
| Molecular Weight | 808.55597 g/mol |
| XLogP | 20.5 |
| Topological Polar Surface Area (TPSA) | 47.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 26 |
| Exact Mass | 808.55597 Da |
| Heavy Atoms | 58 |
| Complexity | 1020.0 |
| SMILES | CCCCCCCCCC1=CC=C(C=C1)OP(OC2=CC=C(C=C2)CCCCCCCCC)OC3=C(C=C(C=C3)C(C)(C)C4=CC(=C(C=C4)O)C(C)(C)C)C(C)(C)C |
| InChIKey | GVCIJKWSBDKBJP-UHFFFAOYSA-N |
The XLogP value of 20.5 indicates that 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite is 20227-53-6.
The molecular formula of 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite is C53H77O4P.
The molecular weight of 4,4'-Isopropylidenebis(2-tert-butylphenol) bis(4-nonylphenyl) phosphite is 808.55597 g/mol.
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