![3-Amino-[1,1'-biphenyl]-4-carbonitrile structure](/static/products/1495/149505-72-6.webp)
3-Amino-[1,1'-biphenyl]-4-carbonitrile
TL;DR: 3-Amino-[1,1'-biphenyl]-4-carbonitrile (CAS 149505-72-6) is a chemical compound with molecular formula C13H10N2 and molecular weight 194.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-phenylbenzonitrile
Also Known As: 2-amino-4-phenylbenzonitrile, 3-Amino-4-cyanobiphenyl, 3-amino-[1,1'-biphenyl]-4-carbonitrile, 3-aMinobiphenyl-4-carbonitrile, 2-amino-4-phenyl-benzonitrile
| Molecular Formula | C13H10N2 |
|---|---|
| Molecular Weight | 194.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.0844 |
| Heavy Atoms | 15 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 149505-72-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=C(C=C2)C#N)N |
| InChIKey | GJYGLOUBZCWQSV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-[1,1'-biphenyl]-4-carbonitrile (CAS 149505-72-6), with molecular formula C13H10N2 and molecular weight 194.08 g/mol. IUPAC: 2-amino-4-phenylbenzonitrile.
Chemical Property Profile of 3-Amino-[1,1'-biphenyl]-4-carbonitrile
Property Insights of 3-Amino-[1,1'-biphenyl]-4-carbonitrile
The XLogP value of 3.1 indicates that 3-Amino-[1,1'-biphenyl]-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, 3-Amino-[1,1'-biphenyl]-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-[1,1'-biphenyl]-4-carbonitrile 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 3-Amino-[1,1'-biphenyl]-4-carbonitrile?
The CAS number of 3-Amino-[1,1'-biphenyl]-4-carbonitrile is 149505-72-6.
What is the molecular formula of 3-Amino-[1,1'-biphenyl]-4-carbonitrile?
The molecular formula of 3-Amino-[1,1'-biphenyl]-4-carbonitrile is C13H10N2.
What is the molecular weight of 3-Amino-[1,1'-biphenyl]-4-carbonitrile?
The molecular weight of 3-Amino-[1,1'-biphenyl]-4-carbonitrile is 194.08 g/mol.
Where can I buy 3-Amino-[1,1'-biphenyl]-4-carbonitrile?
You can request a quote for 3-Amino-[1,1'-biphenyl]-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-[1,1'-biphenyl]-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-[1,1'-biphenyl]-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.