6-Aminochrysene-1,2-dihydrodiol
TL;DR: 6-Aminochrysene-1,2-dihydrodiol (CAS 117760-93-7) is a chemical compound with molecular formula C18H15NO2 and molecular weight 277.1103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2S)-6-amino-1,2-dihydrochrysene-1,2-diol
Also Known As: 6-Aminochrysene-1,2-dihydrodiol, trans-6-Aminochrysene-1,2-dihydrodiol, trans-1,2-Dihydro-1,2-dihydroxy-6-aminochrysene, (1S,2S)-6-amino-1,2-dihydrochrysene-1,2-diol, SID:53788142
Technical Specifications
| Molecular Formula | C18H15NO2 |
| Molecular Weight | 277.1103 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 277.1103 Da |
| Heavy Atoms | 21 |
| Complexity | 423.0 |
| SMILES | C1=CC=C2C(=C1)C3=C(C=C2N)C4=C(C=C3)[C@@H]([C@H](C=C4)O)O |
| InChIKey | BDQUGJCOXDENQA-ROUUACIJSA-N |
Chemical Property Profile of 6-Aminochrysene-1,2-dihydrodiol
Property Insights of 6-Aminochrysene-1,2-dihydrodiol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Aminochrysene-1,2-dihydrodiol. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Aminochrysene-1,2-dihydrodiol. Following Lipinski's Rule of Five, 6-Aminochrysene-1,2-dihydrodiol has 3 hydrogen bond donor(s) and 3 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-Aminochrysene-1,2-dihydrodiol?
The CAS number of 6-Aminochrysene-1,2-dihydrodiol is 117760-93-7.
What is the molecular formula of 6-Aminochrysene-1,2-dihydrodiol?
The molecular formula of 6-Aminochrysene-1,2-dihydrodiol is C18H15NO2.
What is the molecular weight of 6-Aminochrysene-1,2-dihydrodiol?
The molecular weight of 6-Aminochrysene-1,2-dihydrodiol is 277.1103 g/mol.
Where can I buy 6-Aminochrysene-1,2-dihydrodiol?
You can request a quote for 6-Aminochrysene-1,2-dihydrodiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Aminochrysene-1,2-dihydrodiol?
Yes, CoreyChem provides custom synthesis services for 6-Aminochrysene-1,2-dihydrodiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.