N,N'-bis(3-nitrophenyl)methanediamine
TL;DR: N,N'-bis(3-nitrophenyl)methanediamine (CAS 76284-98-5) is a chemical compound with molecular formula C13H12N4O4 and molecular weight 288.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-bis(3-nitrophenyl)methanediamine
Also Known As: N,N'-bis(3-nitrophenyl)methanediamine, n,n'-methylenebis(3-nitroaniline), N,N-bis(3-nitrophenyl)methanediamine, methanediamine, n,n'-bis(3-nitrophenyl)-, 3-nitro-N-{[(3-nitrophenyl)amino]methyl}aniline
| Molecular Formula | C13H12N4O4 |
|---|---|
| Molecular Weight | 288.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.08585 |
| Heavy Atoms | 21 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 76284-98-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NCNC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | YHYKPYFDKLUFNP-UHFFFAOYSA-N |
Product Overview
N,N'-bis(3-nitrophenyl)methanediamine (CAS 76284-98-5), with molecular formula C13H12N4O4 and molecular weight 288.09 g/mol. IUPAC: N,N'-bis(3-nitrophenyl)methanediamine.
Chemical Property Profile of N,N'-bis(3-nitrophenyl)methanediamine
Property Insights of N,N'-bis(3-nitrophenyl)methanediamine
The XLogP value of 3.3 indicates that N,N'-bis(3-nitrophenyl)methanediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-bis(3-nitrophenyl)methanediamine. Following Lipinski's Rule of Five, N,N'-bis(3-nitrophenyl)methanediamine 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 N,N'-bis(3-nitrophenyl)methanediamine?
The CAS number of N,N'-bis(3-nitrophenyl)methanediamine is 76284-98-5.
What is the molecular formula of N,N'-bis(3-nitrophenyl)methanediamine?
The molecular formula of N,N'-bis(3-nitrophenyl)methanediamine is C13H12N4O4.
What is the molecular weight of N,N'-bis(3-nitrophenyl)methanediamine?
The molecular weight of N,N'-bis(3-nitrophenyl)methanediamine is 288.09 g/mol.
Where can I buy N,N'-bis(3-nitrophenyl)methanediamine?
You can request a quote for N,N'-bis(3-nitrophenyl)methanediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-bis(3-nitrophenyl)methanediamine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-bis(3-nitrophenyl)methanediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.