3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile
TL;DR: 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile (CAS 43036-05-1) is a chemical compound with molecular formula C8H8N2O and molecular weight 148.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-formylpyrrol-1-yl)propanenitrile
Also Known As: 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile, Axitinib, 3-(2-formylpyrrol-1-yl)propanenitrile, 3-(2-formylpyrrolyl)propanenitrile, 1H-Pyrrole-1-propanenitrile,2-formyl-
| Molecular Formula | C8H8N2O |
|---|---|
| Molecular Weight | 148.06 g/mol |
| LogP | 1.21428 |
| Topological Polar Surface Area | 45.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 148.06366 |
| Heavy Atoms | 11 |
| Complexity | 282.5273 |
Chemical Identifiers
| CAS Number | 43036-05-1 |
|---|---|
| SMILES | C1=CN(C(=C1)C=O)CCC#N |
Product Overview
3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile (CAS 43036-05-1), with molecular formula C8H8N2O and molecular weight 148.06 g/mol. IUPAC: 3-(2-formylpyrrol-1-yl)propanenitrile.
Chemical Property Profile of 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile
Property Insights of 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile
The XLogP value of 1.21428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile. With a topological polar surface area (TPSA) of 45.79 Ų, 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile has 0 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-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile?
The CAS number of 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile is 43036-05-1.
What is the molecular formula of 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile?
The molecular formula of 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile is C8H8N2O.
What is the molecular weight of 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile?
The molecular weight of 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile is 148.06 g/mol.
Where can I buy 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile?
You can request a quote for 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Formyl-1H-Pyrrol-1-Yl)Propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.