2-Toluoyl dimethylaminoethanol
TL;DR: 2-Toluoyl dimethylaminoethanol (CAS 63699-33-2) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 2-methylbenzoate
Also Known As: ortho-Toluoyl deanol, o-Toluoyl dimethylaminoethanol, 2-Toluoyl dimethylaminoethanol, 2-(dimethylamino)ethyl 2-methylbenzoate, 2-dimethylaminoethyl 2-methylbenzoate
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 1.71342 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 334.14893 |
Chemical Identifiers
| CAS Number | 63699-33-2 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)OCCN(C)C |
Product Overview
2-Toluoyl dimethylaminoethanol (CAS 63699-33-2), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: 2-(dimethylamino)ethyl 2-methylbenzoate.
Chemical Property Profile of 2-Toluoyl dimethylaminoethanol
Property Insights of 2-Toluoyl dimethylaminoethanol
The XLogP value of 1.71342 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Toluoyl dimethylaminoethanol. With a topological polar surface area (TPSA) of 29.54 Ų, 2-Toluoyl dimethylaminoethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Toluoyl dimethylaminoethanol has 0 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 2-Toluoyl dimethylaminoethanol?
The CAS number of 2-Toluoyl dimethylaminoethanol is 63699-33-2.
What is the molecular formula of 2-Toluoyl dimethylaminoethanol?
The molecular formula of 2-Toluoyl dimethylaminoethanol is C12H17NO2.
What is the molecular weight of 2-Toluoyl dimethylaminoethanol?
The molecular weight of 2-Toluoyl dimethylaminoethanol is 207.13 g/mol.
Where can I buy 2-Toluoyl dimethylaminoethanol?
You can request a quote for 2-Toluoyl dimethylaminoethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Toluoyl dimethylaminoethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-Toluoyl dimethylaminoethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.