N-(4-fluorobenzyl)butan-2-amine
TL;DR: N-(4-fluorobenzyl)butan-2-amine (CAS 343854-19-3) is a chemical compound with molecular formula C11H16FN and molecular weight 181.12668 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-fluorophenyl)methyl]butan-2-amine
Also Known As: N-(4-fluorobenzyl)butan-2-amine, Methyl-N-phenyladipamat, N-[(4-fluorophenyl)methyl]butan-2-amine, (butan-2-yl)[(4-fluorophenyl)methyl]amine, CHEMBRDG-BB 4024885
Technical Specifications
| Molecular Formula | C11H16FN |
| Molecular Weight | 181.12668 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 181.12668 Da |
| Heavy Atoms | 13 |
| Complexity | 130.0 |
| SMILES | CCC(C)NCC1=CC=C(C=C1)F |
| InChIKey | ZDIMCFHGMAHYSX-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-fluorobenzyl)butan-2-amine
Property Insights of N-(4-fluorobenzyl)butan-2-amine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-fluorobenzyl)butan-2-amine. With a topological polar surface area (TPSA) of 12.0 Ų, N-(4-fluorobenzyl)butan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-fluorobenzyl)butan-2-amine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-fluorobenzyl)butan-2-amine?
The CAS number of N-(4-fluorobenzyl)butan-2-amine is 343854-19-3.
What is the molecular formula of N-(4-fluorobenzyl)butan-2-amine?
The molecular formula of N-(4-fluorobenzyl)butan-2-amine is C11H16FN.
What is the molecular weight of N-(4-fluorobenzyl)butan-2-amine?
The molecular weight of N-(4-fluorobenzyl)butan-2-amine is 181.12668 g/mol.
Where can I buy N-(4-fluorobenzyl)butan-2-amine?
You can request a quote for N-(4-fluorobenzyl)butan-2-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-fluorobenzyl)butan-2-amine?
Yes, CoreyChem provides custom synthesis services for N-(4-fluorobenzyl)butan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.