1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-
TL;DR: 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- (CAS 114136-87-7) is a chemical compound with molecular formula C14H30N4O4 and molecular weight 318.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-bis(2-methyl-2-nitropropyl)hexane-1,6-diamine
Also Known As: 1,6-Hexanediamine, N,N'-bis(2-methyl-2-nitropropyl)-, N,N'-bis(2-methyl-2-nitropropyl)hexane-1,6-diamine, 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-, N,N/'-Bis(2-methyl-2-nitropropyl)hexamethylenediamine, n,n'-bis(2-methyl-2-nitropropyl)-1,6-diaminohexane
| Molecular Formula | C14H30N4O4 |
|---|---|
| Molecular Weight | 318.23 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 318.2267 |
| Heavy Atoms | 22 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 114136-87-7 |
|---|---|
| SMILES | CC(C)(CNCCCCCCNCC(C)(C)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | RWKWYSIDDAGTKA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- (CAS 114136-87-7), with molecular formula C14H30N4O4 and molecular weight 318.23 g/mol. IUPAC: N,N'-bis(2-methyl-2-nitropropyl)hexane-1,6-diamine.
Chemical Property Profile of 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-
Property Insights of 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-. Following Lipinski's Rule of Five, 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- has 2 hydrogen bond donor(s) and 6 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 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-?
The CAS number of 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- is 114136-87-7.
What is the molecular formula of 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-?
The molecular formula of 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- is C14H30N4O4.
What is the molecular weight of 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-?
The molecular weight of 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- is 318.23 g/mol.
Where can I buy 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-?
You can request a quote for 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Hexanediamine, N1,N6-bis(2-methyl-2-nitropropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.