Propane-1,3-diamine, 2-t-butyl-
TL;DR: Propane-1,3-diamine, 2-t-butyl- (CAS 56041-82-8) is a chemical compound with molecular formula C7H18N2 and molecular weight 130.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butylpropane-1,3-diamine
Also Known As: 2-tert-Butyl-1,3-propanediamine, Propane-1,3-diamine, 2-t-butyl-, 2-tert-butylpropane-1,3-diamine, 2-tert-Butyl-1,3-propanediamine #, 2-(Aminomethyl)-3,3-dimethylbutan-1-amine
| Molecular Formula | C7H18N2 |
|---|---|
| Molecular Weight | 130.15 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.147 |
| Heavy Atoms | 9 |
| Complexity | 69.0 |
Chemical Identifiers
| CAS Number | 56041-82-8 |
|---|---|
| SMILES | CC(C)(C)C(CN)CN |
| InChIKey | NKMQNKNMUHHDAN-UHFFFAOYSA-N |
Product Overview
Propane-1,3-diamine, 2-t-butyl- (CAS 56041-82-8), with molecular formula C7H18N2 and molecular weight 130.15 g/mol. IUPAC: 2-tert-butylpropane-1,3-diamine.
Chemical Property Profile of Propane-1,3-diamine, 2-t-butyl-
Property Insights of Propane-1,3-diamine, 2-t-butyl-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propane-1,3-diamine, 2-t-butyl-. With a topological polar surface area (TPSA) of 52.0 Ų, Propane-1,3-diamine, 2-t-butyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propane-1,3-diamine, 2-t-butyl- 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 Propane-1,3-diamine, 2-t-butyl-?
The CAS number of Propane-1,3-diamine, 2-t-butyl- is 56041-82-8.
What is the molecular formula of Propane-1,3-diamine, 2-t-butyl-?
The molecular formula of Propane-1,3-diamine, 2-t-butyl- is C7H18N2.
What is the molecular weight of Propane-1,3-diamine, 2-t-butyl-?
The molecular weight of Propane-1,3-diamine, 2-t-butyl- is 130.15 g/mol.
Where can I buy Propane-1,3-diamine, 2-t-butyl-?
You can request a quote for Propane-1,3-diamine, 2-t-butyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propane-1,3-diamine, 2-t-butyl-?
Yes, KEHONG BIO provides custom synthesis services for Propane-1,3-diamine, 2-t-butyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.