Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-
TL;DR: Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- (CAS 90389-87-0) is a chemical compound with molecular formula C10H14FN and molecular weight 167.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-fluorophenyl)methyl]propan-2-amine
Also Known As: Benzylamine der, N-(3-Fluorobenzyl)propan-2-amine, (3-Fluoro-benzyl)-isopropyl-amine, N-[(3-fluorophenyl)methyl]propan-2-amine, [(3-fluorophenyl)methyl](propan-2-yl)amine
| Molecular Formula | C10H14FN |
|---|---|
| Molecular Weight | 167.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.11102 |
| Heavy Atoms | 12 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 90389-87-0 |
|---|---|
| SMILES | CC(C)NCC1=CC(=CC=C1)F |
| InChIKey | LULJUYVORLDSFI-UHFFFAOYSA-N |
Product Overview
Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- (CAS 90389-87-0), with molecular formula C10H14FN and molecular weight 167.11 g/mol. IUPAC: N-[(3-fluorophenyl)methyl]propan-2-amine.
Chemical Property Profile of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-
Property Insights of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-. With a topological polar surface area (TPSA) of 12.0 Ų, Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- 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
Frequently Asked Questions
What is the CAS number of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-?
The CAS number of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- is 90389-87-0.
What is the molecular formula of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-?
The molecular formula of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- is C10H14FN.
What is the molecular weight of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-?
The molecular weight of Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- is 167.11 g/mol.
Where can I buy Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-?
You can request a quote for Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanamine, 3-fluoro-N-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanamine, 3-fluoro-N-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.