2-Methyl-1,4-diaminobutane
TL;DR: 2-Methyl-1,4-diaminobutane (CAS 94234-16-9) is a chemical compound with molecular formula C5H14N2 and molecular weight 102.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylbutane-1,4-diamine
Also Known As: 2-methylbutane-1,4-diamine, 2-methylputrescine, 2-Methyl-1,4-diaminobutane, 2-Methylputresine, 2-methyl-1,4-butanediamine
| Molecular Formula | C5H14N2 |
|---|---|
| Molecular Weight | 102.12 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 102.1157 |
| Heavy Atoms | 7 |
| Complexity | 37.0 |
Chemical Identifiers
| CAS Number | 94234-16-9 |
|---|---|
| SMILES | CC(CCN)CN |
| InChIKey | GGQJPAQXCYUEKB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-1,4-diaminobutane (CAS 94234-16-9), with molecular formula C5H14N2 and molecular weight 102.12 g/mol. IUPAC: 2-methylbutane-1,4-diamine.
Chemical Property Profile of 2-Methyl-1,4-diaminobutane
Property Insights of 2-Methyl-1,4-diaminobutane
The XLogP value of -0.5 indicates that 2-Methyl-1,4-diaminobutane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.0 Ų, 2-Methyl-1,4-diaminobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1,4-diaminobutane 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-Methyl-1,4-diaminobutane?
The CAS number of 2-Methyl-1,4-diaminobutane is 94234-16-9.
What is the molecular formula of 2-Methyl-1,4-diaminobutane?
The molecular formula of 2-Methyl-1,4-diaminobutane is C5H14N2.
What is the molecular weight of 2-Methyl-1,4-diaminobutane?
The molecular weight of 2-Methyl-1,4-diaminobutane is 102.12 g/mol.
Where can I buy 2-Methyl-1,4-diaminobutane?
You can request a quote for 2-Methyl-1,4-diaminobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1,4-diaminobutane?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1,4-diaminobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.