2-Ethyl-1,4-butanediamine
TL;DR: 2-Ethyl-1,4-butanediamine (CAS 63009-16-5) is a chemical compound with molecular formula C6H16N2 and molecular weight 116.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylbutane-1,4-diamine
Also Known As: 2-Ethylbutane-1,4-diamine, 2-ethyltetramethylenediamine, 2-ethyl-1,4-butanediamine, EINECS 263-789-2, 1,4-Butanediamine,2-ethyl-
| Molecular Formula | C6H16N2 |
|---|---|
| Molecular Weight | 116.13 g/mol |
| LogP | 0.3201 |
| Topological Polar Surface Area | 52.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 116.13135 |
| Heavy Atoms | 8 |
| Complexity | 41.793194 |
Chemical Identifiers
| CAS Number | 63009-16-5 |
|---|---|
| SMILES | CCC(CCN)CN |
Product Overview
2-Ethyl-1,4-butanediamine (CAS 63009-16-5), with molecular formula C6H16N2 and molecular weight 116.13 g/mol. IUPAC: 2-ethylbutane-1,4-diamine.
Chemical Property Profile of 2-Ethyl-1,4-butanediamine
Property Insights of 2-Ethyl-1,4-butanediamine
The XLogP value of 0.3201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-1,4-butanediamine. With a topological polar surface area (TPSA) of 52.04 Ų, 2-Ethyl-1,4-butanediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-1,4-butanediamine 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
Frequently Asked Questions
What is the CAS number of 2-Ethyl-1,4-butanediamine?
The CAS number of 2-Ethyl-1,4-butanediamine is 63009-16-5.
What is the molecular formula of 2-Ethyl-1,4-butanediamine?
The molecular formula of 2-Ethyl-1,4-butanediamine is C6H16N2.
What is the molecular weight of 2-Ethyl-1,4-butanediamine?
The molecular weight of 2-Ethyl-1,4-butanediamine is 116.13 g/mol.
Where can I buy 2-Ethyl-1,4-butanediamine?
You can request a quote for 2-Ethyl-1,4-butanediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-1,4-butanediamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-1,4-butanediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.