Pyrimidine, 2-(1,1-dimethylethyl)-
TL;DR: Pyrimidine, 2-(1,1-dimethylethyl)- (CAS 61319-99-1) is a chemical compound with molecular formula C8H12N2 and molecular weight 136.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butylpyrimidine
Also Known As: 2-tert-butylpyrimidine, 2-t-Butylpyrimidine, Pyrimidine, 2-(1,1-dimethylethyl)-, 2-(tert-butyl)pyrimidine, 2-tert.butyl-pyrimidine
| Molecular Formula | C8H12N2 |
|---|---|
| Molecular Weight | 136.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.10005 |
| Heavy Atoms | 10 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 61319-99-1 |
|---|---|
| SMILES | CC(C)(C)C1=NC=CC=N1 |
| InChIKey | PXEJBTJCBLQUKS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyrimidine, 2-(1,1-dimethylethyl)- (CAS 61319-99-1), with molecular formula C8H12N2 and molecular weight 136.10 g/mol. IUPAC: 2-tert-butylpyrimidine.
Chemical Property Profile of Pyrimidine, 2-(1,1-dimethylethyl)-
Property Insights of Pyrimidine, 2-(1,1-dimethylethyl)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrimidine, 2-(1,1-dimethylethyl)-. With a topological polar surface area (TPSA) of 25.8 Ų, Pyrimidine, 2-(1,1-dimethylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrimidine, 2-(1,1-dimethylethyl)- 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 Pyrimidine, 2-(1,1-dimethylethyl)-?
The CAS number of Pyrimidine, 2-(1,1-dimethylethyl)- is 61319-99-1.
What is the molecular formula of Pyrimidine, 2-(1,1-dimethylethyl)-?
The molecular formula of Pyrimidine, 2-(1,1-dimethylethyl)- is C8H12N2.
What is the molecular weight of Pyrimidine, 2-(1,1-dimethylethyl)-?
The molecular weight of Pyrimidine, 2-(1,1-dimethylethyl)- is 136.10 g/mol.
Where can I buy Pyrimidine, 2-(1,1-dimethylethyl)-?
You can request a quote for Pyrimidine, 2-(1,1-dimethylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrimidine, 2-(1,1-dimethylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrimidine, 2-(1,1-dimethylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.