p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-
TL;DR: p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- (CAS 53335-18-5) is a chemical compound with molecular formula C17H27NO3 and molecular weight 293.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(diethylamino)ethoxy]-6-methyl-3-propan-2-ylbenzoic acid
Also Known As: Benzoic acid, 2-(diethylamino)ethoxy-3-isopropyl-6-methyl-, p-CYMENE-2-CARBOXYLIC ACID, 3-(DIETHYLAMINOETHOXY)-, 3-(2-Diethylaminoethoxy)-p-cymene-2-carboxylic acid, 2-[2-(Diethylamino)ethoxy]-6-methyl-3-(propan-2-yl)benzoic acid, Phosphonic acid,(2-phenyl-1(2H)-pyridinyl)-,diethyl ester
| Molecular Formula | C17H27NO3 |
|---|---|
| Molecular Weight | 293.20 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 293.1991 |
| Heavy Atoms | 21 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 53335-18-5 |
|---|---|
| SMILES | CCN(CC)CCOC1=C(C=CC(=C1C(=O)O)C)C(C)C |
| InChIKey | BSHLEKSMWWVWPI-UHFFFAOYSA-N |
Product Overview
p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- (CAS 53335-18-5), with molecular formula C17H27NO3 and molecular weight 293.20 g/mol. IUPAC: 2-[2-(diethylamino)ethoxy]-6-methyl-3-propan-2-ylbenzoic acid.
Chemical Property Profile of p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-
Property Insights of p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-. With a topological polar surface area (TPSA) of 49.8 Ų, p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- 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 p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-?
The CAS number of p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- is 53335-18-5.
What is the molecular formula of p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-?
The molecular formula of p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- is C17H27NO3.
What is the molecular weight of p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-?
The molecular weight of p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- is 293.20 g/mol.
Where can I buy p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-?
You can request a quote for p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)-?
Yes, KEHONG BIO provides custom synthesis services for p-Cymene-2-carboxylic acid, 3-(diethylaminoethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.