N,N'-Dimethylnitrosourea
TL;DR: N,N'-Dimethylnitrosourea (CAS 55120-47-3) is a chemical compound with molecular formula C3H7N3O2 and molecular weight 117.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethyl-3-nitrosourea
Also Known As: N,N'-Dimethylnitrosourea, Dimethylnitrosourea, N-Dimethyl-N-nitroso urea, N-Dimethyl-N-nitrosourea, N,N-Dimethylnitrosourea
| Molecular Formula | C3H7N3O2 |
|---|---|
| Molecular Weight | 117.05 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 117.053825 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 55120-47-3 |
|---|---|
| SMILES | CN(C)C(=O)NN=O |
| InChIKey | VSMLKOBHLXAHFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-Dimethylnitrosourea (CAS 55120-47-3), with molecular formula C3H7N3O2 and molecular weight 117.05 g/mol. IUPAC: 1,1-dimethyl-3-nitrosourea.
Chemical Property Profile of N,N'-Dimethylnitrosourea
Property Insights of N,N'-Dimethylnitrosourea
The XLogP value of -0.7 indicates that N,N'-Dimethylnitrosourea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-Dimethylnitrosourea. Following Lipinski's Rule of Five, N,N'-Dimethylnitrosourea has 1 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,N'-Dimethylnitrosourea?
The CAS number of N,N'-Dimethylnitrosourea is 55120-47-3.
What is the molecular formula of N,N'-Dimethylnitrosourea?
The molecular formula of N,N'-Dimethylnitrosourea is C3H7N3O2.
What is the molecular weight of N,N'-Dimethylnitrosourea?
The molecular weight of N,N'-Dimethylnitrosourea is 117.05 g/mol.
Where can I buy N,N'-Dimethylnitrosourea?
You can request a quote for N,N'-Dimethylnitrosourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Dimethylnitrosourea?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Dimethylnitrosourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.