Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride
TL;DR: Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride (CAS 55066-58-5) is a chemical compound with molecular formula C19H24ClNO3 and molecular weight 349.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)propyl 2-hydroxy-2,2-diphenylacetate;hydrochloride
Also Known As: 3-(Dimethylamino)propyl benzilate hydrochloride, Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride, 3-(dimethylamino)propyl 2-hydroxy-2,2-diphenylacetate hydrochloride, 3-(Dimethylamino)propyl hydroxydi(phenyl)acetate--hydrogen chloride (1/1), Benzeneacetic acid, .alpha.-hydroxy-.alpha.-phenyl-, 3-(dimethylamino)propyl ester, hydrochloride
| Molecular Formula | C19H24ClNO3 |
|---|---|
| Molecular Weight | 349.14 g/mol |
| LogP | 2.84 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 349.14447 |
| Heavy Atoms | 24 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 55066-58-5 |
|---|---|
| SMILES | CN(C)CCCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl |
| InChIKey | LINOLFHDHJMDKP-UHFFFAOYSA-N |
Product Overview
Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride (CAS 55066-58-5), with molecular formula C19H24ClNO3 and molecular weight 349.14 g/mol. IUPAC: 3-(dimethylamino)propyl 2-hydroxy-2,2-diphenylacetate;hydrochloride.
Chemical Property Profile of Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride
Property Insights of Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride
The XLogP value of 2.84 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride. With a topological polar surface area (TPSA) of 49.8 Ų, Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride has 2 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 Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride?
The CAS number of Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride is 55066-58-5.
What is the molecular formula of Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride?
The molecular formula of Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride is C19H24ClNO3.
What is the molecular weight of Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride?
The molecular weight of Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride is 349.14 g/mol.
Where can I buy Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride?
You can request a quote for Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzilic acid, 3-(dimethylamino)propyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.