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Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-
TL;DR: Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- (CAS 794457-79-7) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(dimethylamino)ethylamino]benzoic acid
Also Known As: Tetracaine Impurity 18, Tetracaine Impurity 22, Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-, 4-(2-dimethylaminoethylamino)benzoic Acid, 4-[2-(dimethylamino)ethylamino]benzoic acid
| Molecular Formula | C11H16N2O2 |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 1.3583 |
| Topological Polar Surface Area | 52.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.12119 |
| Heavy Atoms | 15 |
| Complexity | 319.86475 |
Chemical Identifiers
| CAS Number | 794457-79-7 |
|---|---|
| SMILES | CN(C)CCNC1=CC=C(C=C1)C(=O)O |
Product Overview
Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- (CAS 794457-79-7), with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol. IUPAC: 4-[2-(dimethylamino)ethylamino]benzoic acid.
Chemical Property Profile of Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-
Property Insights of Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-
The XLogP value of 1.3583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-. With a topological polar surface area (TPSA) of 52.57 Ų, Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-[[2-(dimethylamino)ethyl]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 Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-?
The CAS number of Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- is 794457-79-7.
What is the molecular formula of Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-?
The molecular formula of Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- is C11H16N2O2.
What is the molecular weight of Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-?
The molecular weight of Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- is 208.12 g/mol.
Where can I buy Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-?
You can request a quote for Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-[[2-(dimethylamino)ethyl]amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.