Benzenemethanamine, N,4-dinitro-N-propyl-
TL;DR: Benzenemethanamine, N,4-dinitro-N-propyl- (CAS 83072-89-3) is a chemical compound with molecular formula C10H13N3O4 and molecular weight 239.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-nitrophenyl)methyl]-N-propylnitramide
Also Known As: 2-(N-Lactityl)aminopyridine, Benzenemethanamine, N,4-dinitro-N-propyl-, N-[(4-nitrophenyl)methyl]-N-propylnitramide
| Molecular Formula | C10H13N3O4 |
|---|---|
| Molecular Weight | 239.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 94.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.0906 |
| Heavy Atoms | 17 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 83072-89-3 |
|---|---|
| SMILES | CCCN(CC1=CC=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KGVXQALNGGCFFB-UHFFFAOYSA-N |
Product Overview
Benzenemethanamine, N,4-dinitro-N-propyl- (CAS 83072-89-3), with molecular formula C10H13N3O4 and molecular weight 239.09 g/mol. IUPAC: N-[(4-nitrophenyl)methyl]-N-propylnitramide.
Chemical Property Profile of Benzenemethanamine, N,4-dinitro-N-propyl-
Property Insights of Benzenemethanamine, N,4-dinitro-N-propyl-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanamine, N,4-dinitro-N-propyl-. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenemethanamine, N,4-dinitro-N-propyl-. Following Lipinski's Rule of Five, Benzenemethanamine, N,4-dinitro-N-propyl- has 0 hydrogen bond donor(s) and 5 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 Benzenemethanamine, N,4-dinitro-N-propyl-?
The CAS number of Benzenemethanamine, N,4-dinitro-N-propyl- is 83072-89-3.
What is the molecular formula of Benzenemethanamine, N,4-dinitro-N-propyl-?
The molecular formula of Benzenemethanamine, N,4-dinitro-N-propyl- is C10H13N3O4.
What is the molecular weight of Benzenemethanamine, N,4-dinitro-N-propyl-?
The molecular weight of Benzenemethanamine, N,4-dinitro-N-propyl- is 239.09 g/mol.
Where can I buy Benzenemethanamine, N,4-dinitro-N-propyl-?
You can request a quote for Benzenemethanamine, N,4-dinitro-N-propyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine, N,4-dinitro-N-propyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine, N,4-dinitro-N-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.