2-Butoxybenzene-1,4-diamine
TL;DR: 2-Butoxybenzene-1,4-diamine (CAS 126335-42-0) is a chemical compound with molecular formula C10H16N2O and molecular weight 180.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butoxybenzene-1,4-diamine
Also Known As: 2-butoxybenzene-1,4-diamine, Benzene-1,4-diamine, 2-butoxy-
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H16N2O |
| Molecular Weight | 180.12627 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 61.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.12627 Da |
| Heavy Atoms | 13 |
| Complexity | 141.0 |
| SMILES | CCCCOC1=C(C=CC(=C1)N)N |
| InChIKey | HGYJMGAJUITKNT-UHFFFAOYSA-N |
Chemical Property Profile of 2-Butoxybenzene-1,4-diamine
Property Insights of 2-Butoxybenzene-1,4-diamine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butoxybenzene-1,4-diamine. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butoxybenzene-1,4-diamine. Following Lipinski's Rule of Five, 2-Butoxybenzene-1,4-diamine 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 2-Butoxybenzene-1,4-diamine?
The CAS number of 2-Butoxybenzene-1,4-diamine is 126335-42-0.
What is the molecular formula of 2-Butoxybenzene-1,4-diamine?
The molecular formula of 2-Butoxybenzene-1,4-diamine is C10H16N2O.
What is the molecular weight of 2-Butoxybenzene-1,4-diamine?
The molecular weight of 2-Butoxybenzene-1,4-diamine is 180.12627 g/mol.
Where can I buy 2-Butoxybenzene-1,4-diamine?
You can request a quote for 2-Butoxybenzene-1,4-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butoxybenzene-1,4-diamine?
Yes, CoreyChem provides custom synthesis services for 2-Butoxybenzene-1,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.