((2,3-Dimethylphenyl)amino)acetonitrile
TL;DR: ((2,3-Dimethylphenyl)amino)acetonitrile (CAS 67083-70-9) is a chemical compound with molecular formula C10H12N2 and molecular weight 160.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dimethylanilino)acetonitrile
Also Known As: ((2,3-Dimethylphenyl)amino)acetonitrile, 2-(2,3-dimethylanilino)acetonitrile, EINECS 266-567-3, (2,3-Dimethylanilino)acetonitrile, [(2,3-Dimethylphenyl)amino]acetonitrile
| Molecular Formula | C10H12N2 |
|---|---|
| Molecular Weight | 160.10 g/mol |
| LogP | 2.23892 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.10005 |
| Heavy Atoms | 12 |
| Complexity | 310.1049 |
Chemical Identifiers
| CAS Number | 67083-70-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NCC#N)C |
Product Overview
((2,3-Dimethylphenyl)amino)acetonitrile (CAS 67083-70-9), with molecular formula C10H12N2 and molecular weight 160.10 g/mol. IUPAC: 2-(2,3-dimethylanilino)acetonitrile.
Chemical Property Profile of ((2,3-Dimethylphenyl)amino)acetonitrile
Property Insights of ((2,3-Dimethylphenyl)amino)acetonitrile
The XLogP value of 2.23892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((2,3-Dimethylphenyl)amino)acetonitrile. With a topological polar surface area (TPSA) of 35.82 Ų, ((2,3-Dimethylphenyl)amino)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((2,3-Dimethylphenyl)amino)acetonitrile 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 ((2,3-Dimethylphenyl)amino)acetonitrile?
The CAS number of ((2,3-Dimethylphenyl)amino)acetonitrile is 67083-70-9.
What is the molecular formula of ((2,3-Dimethylphenyl)amino)acetonitrile?
The molecular formula of ((2,3-Dimethylphenyl)amino)acetonitrile is C10H12N2.
What is the molecular weight of ((2,3-Dimethylphenyl)amino)acetonitrile?
The molecular weight of ((2,3-Dimethylphenyl)amino)acetonitrile is 160.10 g/mol.
Where can I buy ((2,3-Dimethylphenyl)amino)acetonitrile?
You can request a quote for ((2,3-Dimethylphenyl)amino)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((2,3-Dimethylphenyl)amino)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for ((2,3-Dimethylphenyl)amino)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.