Carbamic acid, N-methyl-N-nitroso-, phenyl ester
TL;DR: Carbamic acid, N-methyl-N-nitroso-, phenyl ester (CAS 68426-46-0) is a chemical compound with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl N-methyl-N-nitrosocarbamate
Also Known As: Nitrosomethylphenylcarbamate, Phenyl methylnitrosocarbamate, N-Nitroso-N-methylphenylcarbamate, phenyl methyl(nitroso)carbamate, 2,4-Dimethylphenylacetonitrile
| Molecular Formula | C8H8N2O3 |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.0535 |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 68426-46-0 |
|---|---|
| SMILES | CN(C(=O)OC1=CC=CC=C1)N=O |
| InChIKey | LTJREOVCWCRZIZ-UHFFFAOYSA-N |
Product Overview
Carbamic acid, N-methyl-N-nitroso-, phenyl ester (CAS 68426-46-0), with molecular formula C8H8N2O3 and molecular weight 180.05 g/mol. IUPAC: phenyl N-methyl-N-nitrosocarbamate.
Chemical Property Profile of Carbamic acid, N-methyl-N-nitroso-, phenyl ester
Property Insights of Carbamic acid, N-methyl-N-nitroso-, phenyl ester
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, N-methyl-N-nitroso-, phenyl ester. With a topological polar surface area (TPSA) of 59.0 Ų, Carbamic acid, N-methyl-N-nitroso-, phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, N-methyl-N-nitroso-, phenyl ester has 0 hydrogen bond donor(s) and 4 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 Carbamic acid, N-methyl-N-nitroso-, phenyl ester?
The CAS number of Carbamic acid, N-methyl-N-nitroso-, phenyl ester is 68426-46-0.
What is the molecular formula of Carbamic acid, N-methyl-N-nitroso-, phenyl ester?
The molecular formula of Carbamic acid, N-methyl-N-nitroso-, phenyl ester is C8H8N2O3.
What is the molecular weight of Carbamic acid, N-methyl-N-nitroso-, phenyl ester?
The molecular weight of Carbamic acid, N-methyl-N-nitroso-, phenyl ester is 180.05 g/mol.
Where can I buy Carbamic acid, N-methyl-N-nitroso-, phenyl ester?
You can request a quote for Carbamic acid, N-methyl-N-nitroso-, phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, N-methyl-N-nitroso-, phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-methyl-N-nitroso-, phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.