3-Phenylisochroman-1-ol
TL;DR: 3-Phenylisochroman-1-ol (CAS 153396-48-6) is a chemical compound with molecular formula C15H14O2 and molecular weight 226.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-3,4-dihydro-1H-isochromen-1-ol
Also Known As: 3-Phenylisochroman-1-ol, (1R,3R)-3-Phenylisochroman-1-ol, (1S,3R)-3-Phenylisochroman-1-ol, 3-Phenyl-3,4-dihydro-1H-2-benzopyran-1-ol, 3-phenyl-3,4-dihydro-1H-isochromen-1-ol
Technical Specifications
| Molecular Formula | C15H14O2 |
| Molecular Weight | 226.09938 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.09938 Da |
| Heavy Atoms | 17 |
| Complexity | 247.0 |
| SMILES | C1C(OC(C2=CC=CC=C21)O)C3=CC=CC=C3 |
| InChIKey | YHVDJDASXIMISF-UHFFFAOYSA-N |
Chemical Property Profile of 3-Phenylisochroman-1-ol
Property Insights of 3-Phenylisochroman-1-ol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenylisochroman-1-ol. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Phenylisochroman-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenylisochroman-1-ol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Phenylisochroman-1-ol?
The CAS number of 3-Phenylisochroman-1-ol is 153396-48-6.
What is the molecular formula of 3-Phenylisochroman-1-ol?
The molecular formula of 3-Phenylisochroman-1-ol is C15H14O2.
What is the molecular weight of 3-Phenylisochroman-1-ol?
The molecular weight of 3-Phenylisochroman-1-ol is 226.09938 g/mol.
Where can I buy 3-Phenylisochroman-1-ol?
You can request a quote for 3-Phenylisochroman-1-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Phenylisochroman-1-ol?
Yes, CoreyChem provides custom synthesis services for 3-Phenylisochroman-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.