Benzoic acid, 2-(dimethylamino)-, pentyl ester
TL;DR: Benzoic acid, 2-(dimethylamino)-, pentyl ester (CAS 66304-04-9) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.15723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pentyl 2-(dimethylamino)benzoate
Also Known As: pentyl2- benzoate, Amyl o-dimethylaminobenzoate, Pentyl 2-(dimethylamino)benzoate, Benzoic acid, 2-(dimethylamino)-, pentyl ester, 2-(Dimethylamino)benzoic acid pentyl ester
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H21NO2 |
| Molecular Weight | 235.15723 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 235.15723 Da |
| Heavy Atoms | 17 |
| Complexity | 228.0 |
| SMILES | CCCCCOC(=O)C1=CC=CC=C1N(C)C |
| InChIKey | CMOMUQUTZFSRKI-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 2-(dimethylamino)-, pentyl ester
Property Insights of Benzoic acid, 2-(dimethylamino)-, pentyl ester
The XLogP value of 5.1 indicates that Benzoic acid, 2-(dimethylamino)-, pentyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Benzoic acid, 2-(dimethylamino)-, pentyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-(dimethylamino)-, pentyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benzoic acid, 2-(dimethylamino)-, pentyl ester?
The CAS number of Benzoic acid, 2-(dimethylamino)-, pentyl ester is 66304-04-9.
What is the molecular formula of Benzoic acid, 2-(dimethylamino)-, pentyl ester?
The molecular formula of Benzoic acid, 2-(dimethylamino)-, pentyl ester is C14H21NO2.
What is the molecular weight of Benzoic acid, 2-(dimethylamino)-, pentyl ester?
The molecular weight of Benzoic acid, 2-(dimethylamino)-, pentyl ester is 235.15723 g/mol.
Where can I buy Benzoic acid, 2-(dimethylamino)-, pentyl ester?
You can request a quote for Benzoic acid, 2-(dimethylamino)-, pentyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 2-(dimethylamino)-, pentyl ester?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 2-(dimethylamino)-, pentyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.