3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-
TL;DR: 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- (CAS 97841-63-9) is a chemical compound with molecular formula C12H10N4O2 and molecular weight 242.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-formyl-2-(2-oxopropyl)cyclopent-3-ene-1,1,2-tricarbonitrile
Also Known As: 3-amino-4-formyl-2-(2-oxopropyl)cyclopent-3-ene-1,1,2-tricarbonitrile, 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-, A2054/0086386, 3-Amino-4-formyl-2-(2-oxopropyl)-3-cyclopentene-1,1,2-tricarbonitrile, RefChem:278815
| Molecular Formula | C12H10N4O2 |
|---|---|
| Molecular Weight | 242.08 g/mol |
| LogP | 0.32444 |
| Topological Polar Surface Area | 131.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.08037 |
| Heavy Atoms | 18 |
| Complexity | 556.3555 |
Chemical Identifiers
| CAS Number | 97841-63-9 |
|---|---|
| SMILES | CC(=O)CC1(C(=C(CC1(C#N)C#N)C=O)N)C#N |
Product Overview
3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- (CAS 97841-63-9), with molecular formula C12H10N4O2 and molecular weight 242.08 g/mol. IUPAC: 3-amino-4-formyl-2-(2-oxopropyl)cyclopent-3-ene-1,1,2-tricarbonitrile.
Chemical Property Profile of 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-
Property Insights of 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-
The XLogP value of 0.32444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-. The TPSA of 131.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-. Following Lipinski's Rule of Five, 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- has 1 hydrogen bond donor(s) and 6 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-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-?
The CAS number of 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- is 97841-63-9.
What is the molecular formula of 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-?
The molecular formula of 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- is C12H10N4O2.
What is the molecular weight of 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-?
The molecular weight of 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- is 242.08 g/mol.
Where can I buy 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-?
You can request a quote for 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Cyclopentene-1,1,2-tricarbonitrile, 3-amino-4-formyl-2-(2-oxopropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.