2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate
TL;DR: 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate (CAS 60671-90-1) is a chemical compound with molecular formula C12H21BN2O and molecular weight 220.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyborane
Also Known As: 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate, 6-methyl-2-(propan-2-yl)pyrimidin-4-yl diethylborinate, diethyl-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyborane, 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate #, Diethyl[(6-methyl-2-isopropylpyrimidin-4-yl)oxy]borane
| Molecular Formula | C12H21BN2O |
|---|---|
| Molecular Weight | 220.17 g/mol |
| LogP | 3.31852 |
| Topological Polar Surface Area | 35.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.1747 |
| Heavy Atoms | 16 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 60671-90-1 |
|---|---|
| SMILES | B(CC)(CC)OC1=NC(=NC(=C1)C)C(C)C |
| InChIKey | IBRUXFZLCKOVTH-UHFFFAOYSA-N |
Product Overview
2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate (CAS 60671-90-1), with molecular formula C12H21BN2O and molecular weight 220.17 g/mol. IUPAC: diethyl-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyborane.
Chemical Property Profile of 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate
Property Insights of 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate
The XLogP value of 3.31852 indicates that 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.0 Ų, 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate has 0 hydrogen bond donor(s) and 3 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 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate?
The CAS number of 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate is 60671-90-1.
What is the molecular formula of 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate?
The molecular formula of 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate is C12H21BN2O.
What is the molecular weight of 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate?
The molecular weight of 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate is 220.17 g/mol.
Where can I buy 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate?
You can request a quote for 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate?
Yes, KEHONG BIO provides custom synthesis services for 2-Isopropyl-6-methyl-4-pyrimidinyl diethylborinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.