3,3-Dimethylbutane-1,2-diamine
TL;DR: 3,3-Dimethylbutane-1,2-diamine (CAS 157750-90-8) is a chemical compound with molecular formula C6H16N2 and molecular weight 116.13135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-dimethylbutane-1,2-diamine
Also Known As: 3,3-dimethylbutane-1,2-diamine, 3,3-dimethyl-1,2-butanediamine, 1,2-Diamino-3,3-dimethylbutane, 2-AMINO-3,3-DIMETHYLBUTYLAMINE, J2.884.202C
Technical Specifications
| Molecular Formula | C6H16N2 |
| Molecular Weight | 116.13135 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 116.13135 Da |
| Heavy Atoms | 8 |
| Complexity | 63.0 |
| SMILES | CC(C)(C)C(CN)N |
| InChIKey | KKMKAWJAGGJWTJ-UHFFFAOYSA-N |
Chemical Property Profile of 3,3-Dimethylbutane-1,2-diamine
Property Insights of 3,3-Dimethylbutane-1,2-diamine
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethylbutane-1,2-diamine. With a topological polar surface area (TPSA) of 52.0 Ų, 3,3-Dimethylbutane-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethylbutane-1,2-diamine has 2 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 3,3-Dimethylbutane-1,2-diamine?
The CAS number of 3,3-Dimethylbutane-1,2-diamine is 157750-90-8.
What is the molecular formula of 3,3-Dimethylbutane-1,2-diamine?
The molecular formula of 3,3-Dimethylbutane-1,2-diamine is C6H16N2.
What is the molecular weight of 3,3-Dimethylbutane-1,2-diamine?
The molecular weight of 3,3-Dimethylbutane-1,2-diamine is 116.13135 g/mol.
Where can I buy 3,3-Dimethylbutane-1,2-diamine?
You can request a quote for 3,3-Dimethylbutane-1,2-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,3-Dimethylbutane-1,2-diamine?
Yes, CoreyChem provides custom synthesis services for 3,3-Dimethylbutane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.