N-Nitrosonipecotic acid
TL;DR: N-Nitrosonipecotic acid (CAS 67874-91-3) is a chemical compound with molecular formula C6H10N2O3 and molecular weight 158.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitrosopiperidine-3-carboxylic acid
Also Known As: Nitrosonipecotic acid, N-Nitroso Nipecotic Acid, 1-nitrosopiperidine-3-carboxylic acid, N-Nitrosonipecotic acid, 1-Nitrosonipecotic Acid
| Molecular Formula | C6H10N2O3 |
|---|---|
| Molecular Weight | 158.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.06914 |
| Heavy Atoms | 11 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 67874-91-3 |
|---|---|
| SMILES | C1CC(CN(C1)N=O)C(=O)O |
| InChIKey | YGOAQYQGTQBALO-UHFFFAOYSA-N |
Product Overview
N-Nitrosonipecotic acid (CAS 67874-91-3), with molecular formula C6H10N2O3 and molecular weight 158.07 g/mol. IUPAC: 1-nitrosopiperidine-3-carboxylic acid.
Chemical Property Profile of N-Nitrosonipecotic acid
Property Insights of N-Nitrosonipecotic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitrosonipecotic acid. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Nitrosonipecotic acid. Following Lipinski's Rule of Five, N-Nitrosonipecotic acid has 1 hydrogen bond donor(s) and 5 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-Nitrosonipecotic acid?
The CAS number of N-Nitrosonipecotic acid is 67874-91-3.
What is the molecular formula of N-Nitrosonipecotic acid?
The molecular formula of N-Nitrosonipecotic acid is C6H10N2O3.
What is the molecular weight of N-Nitrosonipecotic acid?
The molecular weight of N-Nitrosonipecotic acid is 158.07 g/mol.
Where can I buy N-Nitrosonipecotic acid?
You can request a quote for N-Nitrosonipecotic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nitrosonipecotic acid?
Yes, KEHONG BIO provides custom synthesis services for N-Nitrosonipecotic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.