BADGE-HCl-H2O
TL;DR: BADGE-HCl-H2O (CAS 1203490-24-7) is a chemical compound with molecular formula C21H27ClO5 and molecular weight 394.1547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-[2-[4-(3-chloro-2-hydroxypropoxy)phenyl]propan-2-yl]phenoxy]propane-1,2-diol
Also Known As: BADGE-HCl-H2O, BADGE*H2O*HCl, BADGE-H2O-HCl, Bisphenol A Impurity 4, EPI001
Technical Specifications
| Molecular Formula | C21H27ClO5 |
| Molecular Weight | 394.1547 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 79.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 394.1547 Da |
| Heavy Atoms | 27 |
| Complexity | 403.0 |
| SMILES | CC(C)(C1=CC=C(C=C1)OCC(CO)O)C2=CC=C(C=C2)OCC(CCl)O |
| InChIKey | HDTYUHNZRYZEEB-UHFFFAOYSA-N |
Chemical Property Profile of BADGE-HCl-H2O
Property Insights of BADGE-HCl-H2O
The XLogP value of 3.3 indicates that BADGE-HCl-H2O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BADGE-HCl-H2O. Following Lipinski's Rule of Five, BADGE-HCl-H2O has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BADGE-HCl-H2O?
The CAS number of BADGE-HCl-H2O is 1203490-24-7.
What is the molecular formula of BADGE-HCl-H2O?
The molecular formula of BADGE-HCl-H2O is C21H27ClO5.
What is the molecular weight of BADGE-HCl-H2O?
The molecular weight of BADGE-HCl-H2O is 394.1547 g/mol.
Where can I buy BADGE-HCl-H2O?
You can request a quote for BADGE-HCl-H2O directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BADGE-HCl-H2O?
Yes, CoreyChem provides custom synthesis services for BADGE-HCl-H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.