1-Butylindoline-5,6-diol
TL;DR: 1-Butylindoline-5,6-diol (CAS 139721-22-5) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butyl-2,3-dihydroindole-5,6-diol
Also Known As: 1-Butylindoline-5,6-diol, 1-butyl-2,3-dihydroindole-5,6-diol, 1-butyl-2,3-dihydro-1H-indole-5,6-diol, 1H-Indole-5,6-diol, 1-butyl-2,3-dihydro- (9CI), 1H-Indole-5,6-diol, 1-butyl-2,3-dihydro-
Technical Specifications
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.12593 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.12593 Da |
| Heavy Atoms | 15 |
| Complexity | 210.0 |
| SMILES | CCCCN1CCC2=CC(=C(C=C21)O)O |
| InChIKey | QFFLWFJPXWCDFQ-UHFFFAOYSA-N |
Chemical Property Profile of 1-Butylindoline-5,6-diol
Property Insights of 1-Butylindoline-5,6-diol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butylindoline-5,6-diol. With a topological polar surface area (TPSA) of 43.7 Ų, 1-Butylindoline-5,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butylindoline-5,6-diol has 2 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 1-Butylindoline-5,6-diol?
The CAS number of 1-Butylindoline-5,6-diol is 139721-22-5.
What is the molecular formula of 1-Butylindoline-5,6-diol?
The molecular formula of 1-Butylindoline-5,6-diol is C12H17NO2.
What is the molecular weight of 1-Butylindoline-5,6-diol?
The molecular weight of 1-Butylindoline-5,6-diol is 207.12593 g/mol.
Where can I buy 1-Butylindoline-5,6-diol?
You can request a quote for 1-Butylindoline-5,6-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Butylindoline-5,6-diol?
Yes, CoreyChem provides custom synthesis services for 1-Butylindoline-5,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.