TL;DR: (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)- (CAS 119725-33-6) is a chemical compound with molecular formula C21H18O3 and molecular weight 318.12558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R)-3-hydroxy-2-phenyl-3-(4-phenylphenyl)propanoic acid
Also Known As: (2R,3R)-3-hydroxy-2-phenyl-3-(4-phenylphenyl)propanoic acid, erythro-(+)-beta-Hydroxy-alpha-phenyl-(1,1'-biphenyl)-4-propanoic acid, (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)-, 3-([1,1'-Biphenyl]-4-yl)-3-hydroxy-2-phenylpropanoic acid, beta-Hydroxy-alpha-phenyl-(1,1/'-biphenyl)-4-propanoic acid, (R/',R/')-(+)-
| Molecular Formula | C21H18O3 |
| Molecular Weight | 318.12558 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.12558 Da |
| Heavy Atoms | 24 |
| Complexity | 388.0 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)[C@@H]([C@@H](C3=CC=CC=C3)C(=O)O)O |
| InChIKey | UINTUWKMGYICQF-UXHICEINSA-N |
The XLogP value of 3.6 indicates that (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)- is 119725-33-6.
The molecular formula of (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)- is C21H18O3.
The molecular weight of (1,1'-Biphenyl)-4-propanoic acid, beta-hydroxy-alpha-phenyl-, (R*,R*)-(+)- is 318.12558 g/mol.
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