2-nitro-N-(pentan-3-ylideneamino)aniline
TL;DR: 2-nitro-N-(pentan-3-ylideneamino)aniline (CAS 76368-92-8) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-N-(pentan-3-ylideneamino)aniline
Also Known As: pentan-3-one-(2-nitro-phenylhydrazone), 2-nitro-N-(pentan-3-ylideneamino)aniline, 3-Pentanone, 2-(2-nitrophenyl)hydrazone, 1-(2-Nitrophenyl)-2-(pentan-3-ylidene)hydrazine
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 3.1827 |
| Topological Polar Surface Area | 67.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 395.97107 |
Chemical Identifiers
| CAS Number | 76368-92-8 |
|---|---|
| SMILES | CCC(=NNC1=CC=CC=C1[N+](=O)[O-])CC |
Product Overview
2-nitro-N-(pentan-3-ylideneamino)aniline (CAS 76368-92-8), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: 2-nitro-N-(pentan-3-ylideneamino)aniline.
Chemical Property Profile of 2-nitro-N-(pentan-3-ylideneamino)aniline
Property Insights of 2-nitro-N-(pentan-3-ylideneamino)aniline
The XLogP value of 3.1827 indicates that 2-nitro-N-(pentan-3-ylideneamino)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-nitro-N-(pentan-3-ylideneamino)aniline. Following Lipinski's Rule of Five, 2-nitro-N-(pentan-3-ylideneamino)aniline has 1 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 2-nitro-N-(pentan-3-ylideneamino)aniline?
The CAS number of 2-nitro-N-(pentan-3-ylideneamino)aniline is 76368-92-8.
What is the molecular formula of 2-nitro-N-(pentan-3-ylideneamino)aniline?
The molecular formula of 2-nitro-N-(pentan-3-ylideneamino)aniline is C11H15N3O2.
What is the molecular weight of 2-nitro-N-(pentan-3-ylideneamino)aniline?
The molecular weight of 2-nitro-N-(pentan-3-ylideneamino)aniline is 221.12 g/mol.
Where can I buy 2-nitro-N-(pentan-3-ylideneamino)aniline?
You can request a quote for 2-nitro-N-(pentan-3-ylideneamino)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-nitro-N-(pentan-3-ylideneamino)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-nitro-N-(pentan-3-ylideneamino)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.