3-Amino-2-naphthonitrile
TL;DR: 3-Amino-2-naphthonitrile (CAS 27533-39-7) is a chemical compound with molecular formula C11H8N2 and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-aminonaphthalene-2-carbonitrile
Also Known As: 3-Amino-2-naphthonitrile, 3-aminonaphthalene-2-carbonitrile, 2-Amino-3-cyanonaphthalene, 2-Naphthalenecarbonitrile,3-amino-(9CI), 2-Naphthalenecarbonitrile, 3-amino- (9CI)
| Molecular Formula | C11H8N2 |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 2.29368 |
| Topological Polar Surface Area | 49.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.06874 |
| Heavy Atoms | 13 |
| Complexity | 494.9067 |
Chemical Identifiers
| CAS Number | 27533-39-7 |
|---|---|
| SMILES | C1=CC=C2C=C(C(=CC2=C1)C#N)N |
Product Overview
3-Amino-2-naphthonitrile (CAS 27533-39-7), with molecular formula C11H8N2 and molecular weight 168.07 g/mol. IUPAC: 3-aminonaphthalene-2-carbonitrile.
Chemical Property Profile of 3-Amino-2-naphthonitrile
Property Insights of 3-Amino-2-naphthonitrile
The XLogP value of 2.29368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-2-naphthonitrile. With a topological polar surface area (TPSA) of 49.81 Ų, 3-Amino-2-naphthonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-2-naphthonitrile 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-2-naphthonitrile?
The CAS number of 3-Amino-2-naphthonitrile is 27533-39-7.
What is the molecular formula of 3-Amino-2-naphthonitrile?
The molecular formula of 3-Amino-2-naphthonitrile is C11H8N2.
What is the molecular weight of 3-Amino-2-naphthonitrile?
The molecular weight of 3-Amino-2-naphthonitrile is 168.07 g/mol.
Where can I buy 3-Amino-2-naphthonitrile?
You can request a quote for 3-Amino-2-naphthonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-2-naphthonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-2-naphthonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.