((4-Methoxyphenyl)amino)acetonitrile
TL;DR: ((4-Methoxyphenyl)amino)acetonitrile (CAS 24889-95-0) is a chemical compound with molecular formula C9H10N2O and molecular weight 162.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyanilino)acetonitrile
Also Known As: [(4-methoxyphenyl)amino]acetonitrile|[ amino]acetonitrile|2-[(4-METHOXYPHENYL)AMINO]ACETONITRILE|2-(4-methoxyanilino)acetonitrile|4-Methoxyanilinoacetonitrile|((4-Methoxyphenyl)amino)acetonitrile|(4-Methoxyanilino)acetonitrile|[(4-chlorophenyl)amino]acetonitrile|2-((4-methoxyphenyl)amino)acetonitrile|Acetonitrile, ((4-methoxyphenyl)amino)-|NCI60_005180|246-517-7|EINECS 246-517-7|RefChem:390206|OWNQIZJEBGJLSW-UHFFFAOYSA-N|EN300-135551
| Molecular Formula | C9H10N2O |
|---|---|
| Molecular Weight | 162.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 45.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.07932 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 24889-95-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NCC#N |
| InChIKey | OWNQIZJEBGJLSW-UHFFFAOYSA-N |
Product Overview
((4-Methoxyphenyl)amino)acetonitrile (CAS 24889-95-0), with molecular formula C9H10N2O and molecular weight 162.08 g/mol. IUPAC: 2-(4-methoxyanilino)acetonitrile.
Chemical Property Profile of ((4-Methoxyphenyl)amino)acetonitrile
Property Insights of ((4-Methoxyphenyl)amino)acetonitrile
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((4-Methoxyphenyl)amino)acetonitrile. With a topological polar surface area (TPSA) of 45.1 Ų, ((4-Methoxyphenyl)amino)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((4-Methoxyphenyl)amino)acetonitrile 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-Methoxyphenyl)amino)acetonitrile?
The CAS number of ((4-Methoxyphenyl)amino)acetonitrile is 24889-95-0.
What is the molecular formula of ((4-Methoxyphenyl)amino)acetonitrile?
The molecular formula of ((4-Methoxyphenyl)amino)acetonitrile is C9H10N2O.
What is the molecular weight of ((4-Methoxyphenyl)amino)acetonitrile?
The molecular weight of ((4-Methoxyphenyl)amino)acetonitrile is 162.08 g/mol.
Where can I buy ((4-Methoxyphenyl)amino)acetonitrile?
You can request a quote for ((4-Methoxyphenyl)amino)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((4-Methoxyphenyl)amino)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for ((4-Methoxyphenyl)amino)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.