TL;DR: Propionic acid-13C3 (CAS 153474-35-2) is a chemical compound with molecular formula C3H6O2 and molecular weight 77.046844 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1,2,3-13C3)propanoic acid
Also Known As: Propionic acid-13C3, Propanoic-13C3 Acid, propionic acid, Propanoic acid, Propanoic acid-13C3
| Molecular Formula | C3H6O2 |
| Molecular Weight | 77.046844 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 77.046844 Da |
| Heavy Atoms | 5 |
| Complexity | 40.0 |
| SMILES | [13CH3][13CH2][13C](=O)O |
| InChIKey | XBDQKXXYIPTUBI-VMIGTVKRSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propionic acid-13C3. With a topological polar surface area (TPSA) of 37.3 Ų, Propionic acid-13C3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propionic acid-13C3 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Propionic acid-13C3 is 153474-35-2.
The molecular formula of Propionic acid-13C3 is C3H6O2.
The molecular weight of Propionic acid-13C3 is 77.046844 g/mol.
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