Nitricholine
TL;DR: Nitricholine (CAS 44929-09-1) is a chemical compound with molecular formula C5H13N2O3+ and molecular weight 149.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl(2-nitrooxyethyl)azanium
Also Known As: Nitricholine, N,N,N-Trimethyl-N-(2-nitratoethyl)ammonium, trimethyl(2-nitrooxyethyl)azanium, Trimethyl-(2-nitrooxyethyl)azanium, n,n,n-trimethyl-2-(nitrooxy)ethanaminium
| Molecular Formula | C5H13N2O3+ |
|---|---|
| Molecular Weight | 149.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 149.09262 |
| Heavy Atoms | 10 |
| Complexity | 113.0 |
Chemical Identifiers
| CAS Number | 44929-09-1 |
|---|---|
| SMILES | C[N+](C)(C)CCO[N+](=O)[O-] |
| InChIKey | BZKRACMUAUSOKR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nitricholine (CAS 44929-09-1), with molecular formula C5H13N2O3+ and molecular weight 149.09 g/mol. IUPAC: trimethyl(2-nitrooxyethyl)azanium.
Chemical Property Profile of Nitricholine
Property Insights of Nitricholine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitricholine. With a topological polar surface area (TPSA) of 55.1 Ų, Nitricholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nitricholine has 0 hydrogen bond donor(s) and 3 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 Nitricholine?
The CAS number of Nitricholine is 44929-09-1.
What is the molecular formula of Nitricholine?
The molecular formula of Nitricholine is C5H13N2O3+.
What is the molecular weight of Nitricholine?
The molecular weight of Nitricholine is 149.09 g/mol.
Where can I buy Nitricholine?
You can request a quote for Nitricholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitricholine?
Yes, KEHONG BIO provides custom synthesis services for Nitricholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.