2-(Aminomethyl)butane-1,4-diamine
TL;DR: 2-(Aminomethyl)butane-1,4-diamine (CAS 31333-62-7) is a chemical compound with molecular formula C5H15N3 and molecular weight 117.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(aminomethyl)butane-1,4-diamine
Also Known As: 2-(aminomethyl)butane-1,4-diamine, 1,4-Butanediamine, 2-(aminomethyl)-, 2,7-Diisopropyl-4-cycloheptenon
| Molecular Formula | C5H15N3 |
|---|---|
| Molecular Weight | 117.13 g/mol |
| LogP | -1.1312 |
| Topological Polar Surface Area | 78.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 117.126595 |
| Heavy Atoms | 8 |
| Complexity | 42.938442 |
Chemical Identifiers
| CAS Number | 31333-62-7 |
|---|---|
| SMILES | C(CN)C(CN)CN |
Product Overview
2-(Aminomethyl)butane-1,4-diamine (CAS 31333-62-7), with molecular formula C5H15N3 and molecular weight 117.13 g/mol. IUPAC: 2-(aminomethyl)butane-1,4-diamine.
Chemical Property Profile of 2-(Aminomethyl)butane-1,4-diamine
Property Insights of 2-(Aminomethyl)butane-1,4-diamine
The XLogP value of -1.1312 indicates that 2-(Aminomethyl)butane-1,4-diamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Aminomethyl)butane-1,4-diamine. Following Lipinski's Rule of Five, 2-(Aminomethyl)butane-1,4-diamine 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
Frequently Asked Questions
What is the CAS number of 2-(Aminomethyl)butane-1,4-diamine?
The CAS number of 2-(Aminomethyl)butane-1,4-diamine is 31333-62-7.
What is the molecular formula of 2-(Aminomethyl)butane-1,4-diamine?
The molecular formula of 2-(Aminomethyl)butane-1,4-diamine is C5H15N3.
What is the molecular weight of 2-(Aminomethyl)butane-1,4-diamine?
The molecular weight of 2-(Aminomethyl)butane-1,4-diamine is 117.13 g/mol.
Where can I buy 2-(Aminomethyl)butane-1,4-diamine?
You can request a quote for 2-(Aminomethyl)butane-1,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Aminomethyl)butane-1,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Aminomethyl)butane-1,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.