2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)
TL;DR: 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) (CAS 100311-12-4) is a chemical compound with molecular formula C16H27ClN2O3 and molecular weight 330.17102 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-amino-3-propoxybenzoyl)oxyethyl-diethylazanium chloride
Also Known As: 2-Diethylaminoethyl 4-amino-3-propoxybenzoate hydrochloride, 2-(4-amino-3-propoxybenzoyl)oxyethyl-diethylazanium chloride, 2-(4-amino-3-propoxybenzoyl)oxyethyl-diethylazanium;chloride, 4-Amino-3-propoxy-benzoic acid 2-(diethylamino)ethyl ester hydrochloride, 2-[(4-Amino-3-propoxybenzoyl)oxy]-N,N-diethylethanaminium chlorid e
Technical Specifications
| Molecular Formula | C16H27ClN2O3 |
| Molecular Weight | 330.17102 g/mol |
| XLogP | -1.86 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 330.17102 Da |
| Heavy Atoms | 22 |
| Complexity | 295.0 |
| SMILES | CCCOC1=C(C=CC(=C1)C(=O)OCC[NH+](CC)CC)N.[Cl-] |
| InChIKey | SENDDLZRSZXUBH-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)
Property Insights of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)
The XLogP value of -1.86 indicates that 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1). Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)?
The CAS number of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) is 100311-12-4.
What is the molecular formula of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)?
The molecular formula of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) is C16H27ClN2O3.
What is the molecular weight of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)?
The molecular weight of 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) is 330.17102 g/mol.
Where can I buy 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)?
You can request a quote for 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1)?
Yes, CoreyChem provides custom synthesis services for 2-(Diethylamino)ethyl 4-amino-3-propoxybenzoate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.