Isopropylpyrazine
TL;DR: Isopropylpyrazine (CAS 29460-90-0) is a chemical compound with molecular formula C7H10N2 and molecular weight 122.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-ylpyrazine
Also Known As: 2-Isopropylpyrazine, Isopropylpyrazine, 2-propan-2-ylpyrazine, 2-Isopropyl pyrazine, (1-Methylethyl)pyrazine
| Molecular Formula | C7H10N2 |
|---|---|
| Molecular Weight | 122.08 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 122.0844 |
| Heavy Atoms | 9 |
| Complexity | 81.0 |
| Boiling Point | 70.00 °C. @ 20.00 mm Hg |
| Density | 0.967-0.972 |
| Solubility | soluble in water, organic solvents, oils |
| Refractive Index | 1.486-1.496 |
Chemical Identifiers
| CAS Number | 29460-90-0 |
|---|---|
| SMILES | CC(C)C1=NC=CN=C1 |
| InChIKey | GIMBKDZNMKTZMG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropylpyrazine (CAS 29460-90-0), with molecular formula C7H10N2 and molecular weight 122.08 g/mol. IUPAC: 2-propan-2-ylpyrazine.
Chemical Property Profile of Isopropylpyrazine
Property Insights of Isopropylpyrazine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylpyrazine. With a topological polar surface area (TPSA) of 25.8 Ų, Isopropylpyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropylpyrazine 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 Isopropylpyrazine?
The CAS number of Isopropylpyrazine is 29460-90-0.
What is the molecular formula of Isopropylpyrazine?
The molecular formula of Isopropylpyrazine is C7H10N2.
What is the molecular weight of Isopropylpyrazine?
The molecular weight of Isopropylpyrazine is 122.08 g/mol.
Where can I buy Isopropylpyrazine?
You can request a quote for Isopropylpyrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropylpyrazine?
Yes, KEHONG BIO provides custom synthesis services for Isopropylpyrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.