N-[(3-ethoxyphenyl)methyl]butan-2-amine
TL;DR: N-[(3-ethoxyphenyl)methyl]butan-2-amine (CAS 893576-91-5) is a chemical compound with molecular formula C13H21NO and molecular weight 207.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-ethoxyphenyl)methyl]butan-2-amine
Also Known As: n-(3-Ethoxybenzyl)butan-2-amine, (Butan-2-yl)[(3-ethoxyphenyl)methyl]amine, N-[(3-ethoxyphenyl)methyl]butan-2-amine, (butan-2-yl)(3-ethoxyphenyl)methylamine
| Molecular Formula | C13H21NO |
|---|---|
| Molecular Weight | 207.16 g/mol |
| LogP | 2.9734 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.16231 |
| Heavy Atoms | 15 |
| Complexity | 285.6194 |
Chemical Identifiers
| CAS Number | 893576-91-5 |
|---|---|
| SMILES | CCC(C)NCC1=CC(=CC=C1)OCC |
Product Overview
N-[(3-ethoxyphenyl)methyl]butan-2-amine (CAS 893576-91-5), with molecular formula C13H21NO and molecular weight 207.16 g/mol. IUPAC: N-[(3-ethoxyphenyl)methyl]butan-2-amine.
Chemical Property Profile of N-[(3-ethoxyphenyl)methyl]butan-2-amine
Property Insights of N-[(3-ethoxyphenyl)methyl]butan-2-amine
The XLogP value of 2.9734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-ethoxyphenyl)methyl]butan-2-amine. With a topological polar surface area (TPSA) of 21.26 Ų, N-[(3-ethoxyphenyl)methyl]butan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-ethoxyphenyl)methyl]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
Frequently Asked Questions
What is the CAS number of N-[(3-ethoxyphenyl)methyl]butan-2-amine?
The CAS number of N-[(3-ethoxyphenyl)methyl]butan-2-amine is 893576-91-5.
What is the molecular formula of N-[(3-ethoxyphenyl)methyl]butan-2-amine?
The molecular formula of N-[(3-ethoxyphenyl)methyl]butan-2-amine is C13H21NO.
What is the molecular weight of N-[(3-ethoxyphenyl)methyl]butan-2-amine?
The molecular weight of N-[(3-ethoxyphenyl)methyl]butan-2-amine is 207.16 g/mol.
Where can I buy N-[(3-ethoxyphenyl)methyl]butan-2-amine?
You can request a quote for N-[(3-ethoxyphenyl)methyl]butan-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-ethoxyphenyl)methyl]butan-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-ethoxyphenyl)methyl]butan-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.