6-Bromo-5-hydroxy-3-phenylisochroman
TL;DR: 6-Bromo-5-hydroxy-3-phenylisochroman (CAS 135393-68-9) is a chemical compound with molecular formula C15H13BrO2 and molecular weight 304.0099 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromo-3-phenyl-3,4-dihydro-1H-isochromen-5-ol
Also Known As: BHPIC, 6-Bromo-5-hydroxy-3-phenylisochroman, 6-bromo-3-phenyl-3,4-dihydro-1H-isochromen-5-ol, 6-BROMO-3-PHENYL-3,4-DIHYDRO-1H-2-BENZOPYRAN-5-OL, 1H-2-Benzopyran-5-ol,1-(aminomethyl)-6-bromo-3,4-dihydro-3-phenyl-, hydrochloride, cis- (9CI)
Technical Specifications
| Molecular Formula | C15H13BrO2 |
| Molecular Weight | 304.0099 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 304.0099 Da |
| Heavy Atoms | 18 |
| Complexity | 278.0 |
| SMILES | C1C(OCC2=C1C(=C(C=C2)Br)O)C3=CC=CC=C3 |
| InChIKey | LDHSLLYHMNIOOP-UHFFFAOYSA-N |
Chemical Property Profile of 6-Bromo-5-hydroxy-3-phenylisochroman
Property Insights of 6-Bromo-5-hydroxy-3-phenylisochroman
The XLogP value of 3.5 indicates that 6-Bromo-5-hydroxy-3-phenylisochroman is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 6-Bromo-5-hydroxy-3-phenylisochroman exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-5-hydroxy-3-phenylisochroman 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 6-Bromo-5-hydroxy-3-phenylisochroman?
The CAS number of 6-Bromo-5-hydroxy-3-phenylisochroman is 135393-68-9.
What is the molecular formula of 6-Bromo-5-hydroxy-3-phenylisochroman?
The molecular formula of 6-Bromo-5-hydroxy-3-phenylisochroman is C15H13BrO2.
What is the molecular weight of 6-Bromo-5-hydroxy-3-phenylisochroman?
The molecular weight of 6-Bromo-5-hydroxy-3-phenylisochroman is 304.0099 g/mol.
Where can I buy 6-Bromo-5-hydroxy-3-phenylisochroman?
You can request a quote for 6-Bromo-5-hydroxy-3-phenylisochroman directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Bromo-5-hydroxy-3-phenylisochroman?
Yes, CoreyChem provides custom synthesis services for 6-Bromo-5-hydroxy-3-phenylisochroman and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.