Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate
TL;DR: Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate (CAS 69781-06-2) is a chemical compound with molecular formula C7H10N2O6S and molecular weight 250.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-hydroxyphenyl)-N-methylnitrous amide;sulfuric acid
Also Known As: 4-(N-Methyl-N-nitrosoamino)phenol sulfate, Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate, N-(4-hydroxyphenyl)-N-methylnitrous amide; sulfuric acid, Sulfuric acid--N-(4-hydroxyphenyl)-N-methylnitrous amide (1/1), RefChem:369292
| Molecular Formula | C7H10N2O6S |
|---|---|
| Molecular Weight | 250.03 g/mol |
| LogP | 0.857 |
| Topological Polar Surface Area | 127.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.02596 |
| Heavy Atoms | 16 |
| Complexity | 420.6952 |
Chemical Identifiers
| CAS Number | 69781-06-2 |
|---|---|
| SMILES | CN(C1=CC=C(C=C1)O)N=O.OS(=O)(=O)O |
Product Overview
Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate (CAS 69781-06-2), with molecular formula C7H10N2O6S and molecular weight 250.03 g/mol. IUPAC: N-(4-hydroxyphenyl)-N-methylnitrous amide;sulfuric acid.
Chemical Property Profile of Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate
Property Insights of Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate
The XLogP value of 0.857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate. The TPSA of 127.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate. Following Lipinski's Rule of Five, Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate has 3 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 Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate?
The CAS number of Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate is 69781-06-2.
What is the molecular formula of Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate?
The molecular formula of Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate is C7H10N2O6S.
What is the molecular weight of Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate?
The molecular weight of Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate is 250.03 g/mol.
Where can I buy Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate?
You can request a quote for Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-(N-methyl-N-nitrosoamino)-, sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.