3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile
TL;DR: 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile (CAS 312266-57-2) is a chemical compound with molecular formula C23H18N4 and molecular weight 350.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-naphthalen-1-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
Also Known As: ChemDiv1_025369, 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile, A1688/0072101, 2-AMINO-3,3-DICYANO-4-(1-NAPHTHYL)-4A,5,6,7-TETRAHYDRO-1(4H)-NAPHTHALENYL CYANIDE, 2-amino-4-naphthalen-1-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
| Molecular Formula | C23H18N4 |
|---|---|
| Molecular Weight | 350.15 g/mol |
| LogP | 4.43344 |
| Topological Polar Surface Area | 97.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 350.15314 |
| Heavy Atoms | 27 |
| Complexity | 1098.2482 |
Chemical Identifiers
| CAS Number | 312266-57-2 |
|---|---|
| SMILES | C1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=CC4=CC=CC=C43 |
Product Overview
3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile (CAS 312266-57-2), with molecular formula C23H18N4 and molecular weight 350.15 g/mol. IUPAC: 2-amino-4-naphthalen-1-yl-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile.
Chemical Property Profile of 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile
Property Insights of 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile
The XLogP value of 4.43344 indicates that 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile. Following Lipinski's Rule of Five, 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile has 1 hydrogen bond donor(s) and 4 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-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile?
The CAS number of 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile is 312266-57-2.
What is the molecular formula of 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile?
The molecular formula of 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile is C23H18N4.
What is the molecular weight of 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile?
The molecular weight of 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile is 350.15 g/mol.
Where can I buy 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile?
You can request a quote for 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-amino-6,7,8,8a-tetrahydro-1,1'-binaphthalene-2,2,4(1H)-tricarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.