(4-Aminophenyl)(methoxy)phenylacetonitrile
TL;DR: (4-Aminophenyl)(methoxy)phenylacetonitrile (CAS 61706-40-9) is a chemical compound with molecular formula C15H14N2O and molecular weight 238.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminophenyl)-2-methoxy-2-phenylacetonitrile
Also Known As: 2-(p-Aminophenyl)-2-methoxy-2-phenylacetonitrile, (4-aminophenyl)(methoxy)phenylacetonitrile, 2-(4-aminophenyl)-2-methoxy-2-phenylacetonitrile, (4-Aminophenyl)(methoxy)(phenyl)acetonitrile, ACETONITRILE, 2-(p-AMINOPHENYL)-2-METHOXY-2-PHENYL-
| Molecular Formula | C15H14N2O |
|---|---|
| Molecular Weight | 238.11 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.11061 |
| Heavy Atoms | 18 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 61706-40-9 |
|---|---|
| SMILES | COC(C#N)(C1=CC=CC=C1)C2=CC=C(C=C2)N |
| InChIKey | WPDIOVWEXFQLHW-UHFFFAOYSA-N |
Product Overview
(4-Aminophenyl)(methoxy)phenylacetonitrile (CAS 61706-40-9), with molecular formula C15H14N2O and molecular weight 238.11 g/mol. IUPAC: 2-(4-aminophenyl)-2-methoxy-2-phenylacetonitrile.
Chemical Property Profile of (4-Aminophenyl)(methoxy)phenylacetonitrile
Property Insights of (4-Aminophenyl)(methoxy)phenylacetonitrile
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Aminophenyl)(methoxy)phenylacetonitrile. With a topological polar surface area (TPSA) of 59.0 Ų, (4-Aminophenyl)(methoxy)phenylacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Aminophenyl)(methoxy)phenylacetonitrile 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 (4-Aminophenyl)(methoxy)phenylacetonitrile?
The CAS number of (4-Aminophenyl)(methoxy)phenylacetonitrile is 61706-40-9.
What is the molecular formula of (4-Aminophenyl)(methoxy)phenylacetonitrile?
The molecular formula of (4-Aminophenyl)(methoxy)phenylacetonitrile is C15H14N2O.
What is the molecular weight of (4-Aminophenyl)(methoxy)phenylacetonitrile?
The molecular weight of (4-Aminophenyl)(methoxy)phenylacetonitrile is 238.11 g/mol.
Where can I buy (4-Aminophenyl)(methoxy)phenylacetonitrile?
You can request a quote for (4-Aminophenyl)(methoxy)phenylacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Aminophenyl)(methoxy)phenylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (4-Aminophenyl)(methoxy)phenylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.