2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid
TL;DR: 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid (CAS 7501-88-4) is a chemical compound with molecular formula C9H18N4O3 and molecular weight 230.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-nitrooctan-2-ylideneamino)urea
Also Known As: (5-nitrooctan-2-ylideneamino)urea, 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid
| Molecular Formula | C9H18N4O3 |
|---|---|
| Molecular Weight | 230.14 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 230.1379 |
| Heavy Atoms | 16 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 7501-88-4 |
|---|---|
| SMILES | CCCC(CCC(=NNC(=O)N)C)[N+](=O)[O-] |
| InChIKey | XWQLHAHPXYWCBK-UHFFFAOYSA-N |
Product Overview
2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid (CAS 7501-88-4), with molecular formula C9H18N4O3 and molecular weight 230.14 g/mol. IUPAC: (5-nitrooctan-2-ylideneamino)urea.
Chemical Property Profile of 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid
Property Insights of 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid. Following Lipinski's Rule of Five, 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid has 2 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-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid?
The CAS number of 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid is 7501-88-4.
What is the molecular formula of 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid?
The molecular formula of 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid is C9H18N4O3.
What is the molecular weight of 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid?
The molecular weight of 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid is 230.14 g/mol.
Where can I buy 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid?
You can request a quote for 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Nitrooctan-2-ylidene)hydrazine-1-carboximidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.