3-Fluoro-N,N-dimethyl-Benzenemethanamine
TL;DR: 3-Fluoro-N,N-dimethyl-Benzenemethanamine (CAS 770-18-3) is a chemical compound with molecular formula C9H12FN and molecular weight 153.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-fluorophenyl)-N,N-dimethylmethanamine
Also Known As: 3-Fluorobenzyldimethylamine, 5,5,5-trifluoronorvaline, 3-Fluoro-N,N-dimethyl-Benzenemethanamine, 1-(3-fluorophenyl)-N,N-dimethylmethanamine, N,N-dimethylaminomethyl-1-fluoro-4-benzene
| Molecular Formula | C9H12FN |
|---|---|
| Molecular Weight | 153.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.09538 |
| Heavy Atoms | 11 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 770-18-3 |
|---|---|
| SMILES | CN(C)CC1=CC(=CC=C1)F |
| InChIKey | PVWQBWUMBSZSPU-UHFFFAOYSA-N |
Product Overview
3-Fluoro-N,N-dimethyl-Benzenemethanamine (CAS 770-18-3), with molecular formula C9H12FN and molecular weight 153.10 g/mol. IUPAC: 1-(3-fluorophenyl)-N,N-dimethylmethanamine.
Chemical Property Profile of 3-Fluoro-N,N-dimethyl-Benzenemethanamine
Property Insights of 3-Fluoro-N,N-dimethyl-Benzenemethanamine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Fluoro-N,N-dimethyl-Benzenemethanamine. With a topological polar surface area (TPSA) of 3.2 Ų, 3-Fluoro-N,N-dimethyl-Benzenemethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluoro-N,N-dimethyl-Benzenemethanamine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Fluoro-N,N-dimethyl-Benzenemethanamine?
The CAS number of 3-Fluoro-N,N-dimethyl-Benzenemethanamine is 770-18-3.
What is the molecular formula of 3-Fluoro-N,N-dimethyl-Benzenemethanamine?
The molecular formula of 3-Fluoro-N,N-dimethyl-Benzenemethanamine is C9H12FN.
What is the molecular weight of 3-Fluoro-N,N-dimethyl-Benzenemethanamine?
The molecular weight of 3-Fluoro-N,N-dimethyl-Benzenemethanamine is 153.10 g/mol.
Where can I buy 3-Fluoro-N,N-dimethyl-Benzenemethanamine?
You can request a quote for 3-Fluoro-N,N-dimethyl-Benzenemethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Fluoro-N,N-dimethyl-Benzenemethanamine?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluoro-N,N-dimethyl-Benzenemethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.