N,2-Dimethyl-N-nitroso-2-propanamine
TL;DR: N,2-Dimethyl-N-nitroso-2-propanamine (CAS 2504-18-9) is a chemical compound with molecular formula C5H12N2O and molecular weight 116.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-N-methylnitrous amide
Also Known As: tert-Butylmethylnitrosamine, Methyl-tert-butylnitrosamine, Methyl(T-butyl)nitrosamine, Methyl-t-butylnitrosamine, N-tert-butyl-N-methylnitrous amide
| Molecular Formula | C5H12N2O |
|---|---|
| Molecular Weight | 116.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 116.09496 |
| Heavy Atoms | 8 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 2504-18-9 |
|---|---|
| SMILES | CC(C)(C)N(C)N=O |
| InChIKey | YDNOESAJRGHRAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,2-Dimethyl-N-nitroso-2-propanamine (CAS 2504-18-9), with molecular formula C5H12N2O and molecular weight 116.09 g/mol. IUPAC: N-tert-butyl-N-methylnitrous amide.
Chemical Property Profile of N,2-Dimethyl-N-nitroso-2-propanamine
Property Insights of N,2-Dimethyl-N-nitroso-2-propanamine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,2-Dimethyl-N-nitroso-2-propanamine. With a topological polar surface area (TPSA) of 32.7 Ų, N,2-Dimethyl-N-nitroso-2-propanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,2-Dimethyl-N-nitroso-2-propanamine 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 N,2-Dimethyl-N-nitroso-2-propanamine?
The CAS number of N,2-Dimethyl-N-nitroso-2-propanamine is 2504-18-9.
What is the molecular formula of N,2-Dimethyl-N-nitroso-2-propanamine?
The molecular formula of N,2-Dimethyl-N-nitroso-2-propanamine is C5H12N2O.
What is the molecular weight of N,2-Dimethyl-N-nitroso-2-propanamine?
The molecular weight of N,2-Dimethyl-N-nitroso-2-propanamine is 116.09 g/mol.
Where can I buy N,2-Dimethyl-N-nitroso-2-propanamine?
You can request a quote for N,2-Dimethyl-N-nitroso-2-propanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,2-Dimethyl-N-nitroso-2-propanamine?
Yes, KEHONG BIO provides custom synthesis services for N,2-Dimethyl-N-nitroso-2-propanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.