N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine
TL;DR: N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine (CAS 7474-79-5) is a chemical compound with molecular formula C8H7N3O2 and molecular weight 177.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(methylideneamino)-4-nitrophenyl]methanimine
Also Known As: N,N'-(4-Nitro-1,3-phenylene)dimethanimine, N-[3-(methylideneamino)-4-nitrophenyl]methanimine, N-[5-(METHYLIDENEAMINO)-2-NITRO-PHENYL]METHANIMINE
| Molecular Formula | C8H7N3O2 |
|---|---|
| Molecular Weight | 177.05 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.05383 |
| Heavy Atoms | 13 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 7474-79-5 |
|---|---|
| SMILES | C=NC1=CC(=C(C=C1)[N+](=O)[O-])N=C |
| InChIKey | ZKDWWPRNULCLMF-UHFFFAOYSA-N |
Product Overview
N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine (CAS 7474-79-5), with molecular formula C8H7N3O2 and molecular weight 177.05 g/mol. IUPAC: N-[3-(methylideneamino)-4-nitrophenyl]methanimine.
Chemical Property Profile of N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine
Property Insights of N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine
The XLogP value of 4.1 indicates that N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine. Following Lipinski's Rule of Five, N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine has 0 hydrogen bond donor(s) and 4 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-[5-(Methylideneamino)-2-nitro-phenyl]methanimine?
The CAS number of N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine is 7474-79-5.
What is the molecular formula of N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine?
The molecular formula of N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine is C8H7N3O2.
What is the molecular weight of N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine?
The molecular weight of N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine is 177.05 g/mol.
Where can I buy N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine?
You can request a quote for N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(Methylideneamino)-2-nitro-phenyl]methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.