m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-
TL;DR: m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- (CAS 5819-64-7) is a chemical compound with molecular formula C13H21NO3S and molecular weight 271.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(methylsulfonylmethyl)-4-pentoxyaniline
Also Known As: starbld0012473, m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-, 3-(methylsulfonylmethyl)-4-pentoxyaniline, alpha-(Methylsulfonyl)-4-(pentyloxy)-m-toluidine, 3-((Methylsulfonyl)methyl)-4-(pentyloxy)aniline
| Molecular Formula | C13H21NO3S |
|---|---|
| Molecular Weight | 271.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 271.1242 |
| Heavy Atoms | 18 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 5819-64-7 |
|---|---|
| SMILES | CCCCCOC1=C(C=C(C=C1)N)CS(=O)(=O)C |
| InChIKey | FSBCLKOMNYSLPR-UHFFFAOYSA-N |
Product Overview
m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- (CAS 5819-64-7), with molecular formula C13H21NO3S and molecular weight 271.12 g/mol. IUPAC: 3-(methylsulfonylmethyl)-4-pentoxyaniline.
Chemical Property Profile of m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-
Property Insights of m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-. Following Lipinski's Rule of Five, m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- has 1 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 m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-?
The CAS number of m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- is 5819-64-7.
What is the molecular formula of m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-?
The molecular formula of m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- is C13H21NO3S.
What is the molecular weight of m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-?
The molecular weight of m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- is 271.12 g/mol.
Where can I buy m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-?
You can request a quote for m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for m-Toluidine, alpha-(methylsulfonyl)-4-(pentyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.