N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline
TL;DR: N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline (CAS 3234-76-2) is a chemical compound with molecular formula C13H14N4O4 and molecular weight 290.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-methylcyclohex-2-en-1-ylidene)amino]-2,4-dinitroaniline
Also Known As: N-[(3-METHYL-1-CYCLOHEX-2-ENYLIDENE)AMINO]-2,4-DINITRO-ANILINE, N-[(3-methylcyclohex-2-en-1-ylidene)amino]-2,4-dinitroaniline, N-[(3-methylcyclohex-2-en-1-ylidene)amino]-2,4-dinitroanilin, 1-(2,4-Dinitrophenyl)-2-(3-methylcyclohex-2-en-1-ylidene)hydrazine
| Molecular Formula | C13H14N4O4 |
|---|---|
| Molecular Weight | 290.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.1015 |
| Heavy Atoms | 21 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 3234-76-2 |
|---|---|
| SMILES | CC1=CC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])CCC1 |
| InChIKey | XZXWZRUSEVHJHA-UHFFFAOYSA-N |
Product Overview
N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline (CAS 3234-76-2), with molecular formula C13H14N4O4 and molecular weight 290.10 g/mol. IUPAC: N-[(3-methylcyclohex-2-en-1-ylidene)amino]-2,4-dinitroaniline.
Chemical Property Profile of N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline
Property Insights of N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline. Following Lipinski's Rule of Five, N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline has 1 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-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline?
The CAS number of N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline is 3234-76-2.
What is the molecular formula of N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline?
The molecular formula of N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline is C13H14N4O4.
What is the molecular weight of N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline?
The molecular weight of N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline is 290.10 g/mol.
Where can I buy N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline?
You can request a quote for N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-Methyl-1-cyclohex-2-enylidene)amino]-2,4-dinitro-aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.