2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)
TL;DR: 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) (CAS 100311-22-6) is a chemical compound with molecular formula C15H25BrN2O2 and molecular weight 344.10995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(butylamino)benzoyl]oxyethyl-dimethylazanium bromide
Also Known As: Pantocaine hydrobromide, Tetracaine hydrobromide, Pantocain hydrobromid, Tetracain hydrobromid, Pantocain hydrobromid [German]
Technical Specifications
| Molecular Formula | C15H25BrN2O2 |
| Molecular Weight | 344.10995 g/mol |
| XLogP | -1.8 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 344.10995 Da |
| Heavy Atoms | 20 |
| Complexity | 249.0 |
| SMILES | CCCCNC1=CC=C(C=C1)C(=O)OCC[NH+](C)C.[Br-] |
| InChIKey | JYLAGMQFZICMOQ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)
Property Insights of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)
The XLogP value of -1.8 indicates that 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) 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
What is the CAS number of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)?
The CAS number of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) is 100311-22-6.
What is the molecular formula of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)?
The molecular formula of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) is C15H25BrN2O2.
What is the molecular weight of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)?
The molecular weight of 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) is 344.10995 g/mol.
Where can I buy 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)?
You can request a quote for 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1)?
Yes, CoreyChem provides custom synthesis services for 2-(Dimethylamino)ethyl 4-(butylamino)benzoate--hydrogen bromide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.