Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride
TL;DR: Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride (CAS 451-64-9) is a chemical compound with molecular formula C18H29ClFNO2 and molecular weight 345.18707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(dibutylamino)propyl 4-fluorobenzoate;hydrochloride
Also Known As: Dibutylaminopropyl p-fluorobenzoate hydrochloride, 3-(dibutylamino)propyl 4-fluorobenzoate hydrochloride, BENZOIC ACID, p-FLUORO, DIBUTYLAMINOPROPYL ESTER, HYDROCHLORIDE, 3-(dibutylamino)propyl 4-fluorobenzoate hydrochloride(1:1), 3-(dibutylamino)propyl 4-fluorobenzoate,hydrochloride
Technical Specifications
| Molecular Formula | C18H29ClFNO2 |
| Molecular Weight | 345.18707 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 345.18707 Da |
| Heavy Atoms | 23 |
| Complexity | 283.0 |
| SMILES | CCCCN(CCCC)CCCOC(=O)C1=CC=C(C=C1)F.Cl |
| InChIKey | MGFRIVHHSGQYQI-UHFFFAOYSA-N |
Product Description
Applications: Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride (CAS 451-64-9) is a fine chemical with the molecular formula C18H29ClFNO2 and a molecular weight of 345.19 g/mol. Synonyms include Dibutylaminopropyl p-fluorobenzoate hydrochloride and 3-(dibutylamino)propyl 4-fluorobenzoate hydrochloride.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride
Property Insights of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride
The XLogP value of 4.7 indicates that Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride 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, p-fluoro, dibutylaminopropyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride has 1 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 Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride?
The CAS number of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride is 451-64-9.
What is the molecular formula of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride?
The molecular formula of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride is C18H29ClFNO2.
What is the molecular weight of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride?
The molecular weight of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride is 345.18707 g/mol.
What are the applications of Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride?
Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...
Where can I buy Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride?
You can request a quote for Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, p-fluoro, dibutylaminopropyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.