1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-
TL;DR: 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- (CAS 92-11-5) is a chemical compound with molecular formula C12H19NO2 and molecular weight 209.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(N-ethyl-3-methylanilino)propane-1,2-diol
Also Known As: 3- propane-1,2-diol, 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-, 3-(N-ethyl-3-methylanilino)propane-1,2-diol, 3-(N-Ethyl-m-toluidino)propane-1,2-diol, 1,2-Propanediol, 3-[ethyl(3-methylphenyl)amino]-
| Molecular Formula | C12H19NO2 |
|---|---|
| Molecular Weight | 209.14 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.14159 |
| Heavy Atoms | 15 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 92-11-5 |
|---|---|
| SMILES | CCN(CC(CO)O)C1=CC=CC(=C1)C |
| InChIKey | SJLAXYZNPAEOOM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- (CAS 92-11-5), with molecular formula C12H19NO2 and molecular weight 209.14 g/mol. IUPAC: 3-(N-ethyl-3-methylanilino)propane-1,2-diol.
Chemical Property Profile of 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-
Property Insights of 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-. With a topological polar surface area (TPSA) of 43.7 Ų, 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- has 2 hydrogen bond donor(s) and 3 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 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-?
The CAS number of 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- is 92-11-5.
What is the molecular formula of 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-?
The molecular formula of 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- is C12H19NO2.
What is the molecular weight of 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-?
The molecular weight of 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- is 209.14 g/mol.
Where can I buy 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-?
You can request a quote for 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-(ethyl(3-methylphenyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.