(2-Nitrobenzyl)(2-phenylethyl)amine
TL;DR: (2-Nitrobenzyl)(2-phenylethyl)amine (CAS 418774-35-3) is a chemical compound with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-nitrophenyl)methyl]-2-phenylethanamine
Also Known As: (2-NITROBENZYL)(2-PHENYLETHYL)AMINE, N-(2-nitrobenzyl)-2-phenylethanamine, CHEMBRDG-BB 5536892, CHEMBRDG-BB5536892, (2-Nitro-benzyl)-phenethyl-amine
| Molecular Formula | C15H16N2O2 |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 2.9271 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 256.1212 |
| Heavy Atoms | 19 |
| Complexity | 540.8517 |
Chemical Identifiers
| CAS Number | 418774-35-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNCC2=CC=CC=C2[N+](=O)[O-] |
Product Overview
(2-Nitrobenzyl)(2-phenylethyl)amine (CAS 418774-35-3), with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol. IUPAC: N-[(2-nitrophenyl)methyl]-2-phenylethanamine.
Chemical Property Profile of (2-Nitrobenzyl)(2-phenylethyl)amine
Property Insights of (2-Nitrobenzyl)(2-phenylethyl)amine
The XLogP value of 2.9271 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Nitrobenzyl)(2-phenylethyl)amine. With a topological polar surface area (TPSA) of 55.17 Ų, (2-Nitrobenzyl)(2-phenylethyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Nitrobenzyl)(2-phenylethyl)amine has 1 hydrogen bond donor(s) and 3 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 (2-Nitrobenzyl)(2-phenylethyl)amine?
The CAS number of (2-Nitrobenzyl)(2-phenylethyl)amine is 418774-35-3.
What is the molecular formula of (2-Nitrobenzyl)(2-phenylethyl)amine?
The molecular formula of (2-Nitrobenzyl)(2-phenylethyl)amine is C15H16N2O2.
What is the molecular weight of (2-Nitrobenzyl)(2-phenylethyl)amine?
The molecular weight of (2-Nitrobenzyl)(2-phenylethyl)amine is 256.12 g/mol.
Where can I buy (2-Nitrobenzyl)(2-phenylethyl)amine?
You can request a quote for (2-Nitrobenzyl)(2-phenylethyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Nitrobenzyl)(2-phenylethyl)amine?
Yes, KEHONG BIO provides custom synthesis services for (2-Nitrobenzyl)(2-phenylethyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.