2-nitrophenyl N,N-dimethylsulfamate
TL;DR: 2-nitrophenyl N,N-dimethylsulfamate (CAS 1141-13-5) is a chemical compound with molecular formula C8H10N2O5S and molecular weight 246.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-nitrophenyl) N,N-dimethylsulfamate
Also Known As: 2-nitrophenyl dimethylsulfamate, 2-nitrophenyl N,N-dimethylsulfamate, (2-nitrophenyl) N,N-dimethylsulfamate, 2-nitrophenyl (dimethylamino)sulfonate, F3230-0248
| Molecular Formula | C8H10N2O5S |
|---|---|
| Molecular Weight | 246.03 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.03104 |
| Heavy Atoms | 16 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 1141-13-5 |
|---|---|
| SMILES | CN(C)S(=O)(=O)OC1=CC=CC=C1[N+](=O)[O-] |
| InChIKey | DUFOSISFAFIZAF-UHFFFAOYSA-N |
Product Overview
2-nitrophenyl N,N-dimethylsulfamate (CAS 1141-13-5), with molecular formula C8H10N2O5S and molecular weight 246.03 g/mol. IUPAC: (2-nitrophenyl) N,N-dimethylsulfamate.
Chemical Property Profile of 2-nitrophenyl N,N-dimethylsulfamate
Property Insights of 2-nitrophenyl N,N-dimethylsulfamate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-nitrophenyl N,N-dimethylsulfamate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-nitrophenyl N,N-dimethylsulfamate. Following Lipinski's Rule of Five, 2-nitrophenyl N,N-dimethylsulfamate has 0 hydrogen bond donor(s) and 6 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 2-nitrophenyl N,N-dimethylsulfamate?
The CAS number of 2-nitrophenyl N,N-dimethylsulfamate is 1141-13-5.
What is the molecular formula of 2-nitrophenyl N,N-dimethylsulfamate?
The molecular formula of 2-nitrophenyl N,N-dimethylsulfamate is C8H10N2O5S.
What is the molecular weight of 2-nitrophenyl N,N-dimethylsulfamate?
The molecular weight of 2-nitrophenyl N,N-dimethylsulfamate is 246.03 g/mol.
Where can I buy 2-nitrophenyl N,N-dimethylsulfamate?
You can request a quote for 2-nitrophenyl N,N-dimethylsulfamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-nitrophenyl N,N-dimethylsulfamate?
Yes, KEHONG BIO provides custom synthesis services for 2-nitrophenyl N,N-dimethylsulfamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.