tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate
TL;DR: tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate (CAS 339018-62-1) is a chemical compound with molecular formula C13H19NO5S and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(4-methoxyphenyl)-N-methylsulfonylcarbamate
Also Known As: tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate, Carbamicacid, -,1,1-dimethylethylester, tert-butyl N-(4-methoxyphenyl)-N-(methylsulfonyl)carbamate, tert-butyl N-(4-methoxyphenyl)-N-methylsulfonylcarbamate, 7N-081
| Molecular Formula | C13H19NO5S |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 2.3963 |
| Topological Polar Surface Area | 72.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.0984 |
| Heavy Atoms | 20 |
| Complexity | 571.77423 |
Chemical Identifiers
| CAS Number | 339018-62-1 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N(C1=CC=C(C=C1)OC)S(=O)(=O)C |
Product Overview
tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate (CAS 339018-62-1), with molecular formula C13H19NO5S and molecular weight 301.10 g/mol. IUPAC: tert-butyl N-(4-methoxyphenyl)-N-methylsulfonylcarbamate.
Chemical Property Profile of tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate
Property Insights of tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate
The XLogP value of 2.3963 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate. The TPSA of 72.91 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate. Following Lipinski's Rule of Five, tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate has 0 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 tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate?
The CAS number of tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate is 339018-62-1.
What is the molecular formula of tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate?
The molecular formula of tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate is C13H19NO5S.
What is the molecular weight of tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate?
The molecular weight of tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate is 301.10 g/mol.
Where can I buy tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate?
You can request a quote for tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl (4-methoxyphenyl)(methylsulfonyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.