(Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile
TL;DR: (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile (CAS 219489-15-3) is a chemical compound with molecular formula C10H16BNO2 and molecular weight 193.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enenitrile
Also Known As: (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile, (Z)-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enenitrile
| Molecular Formula | C10H16BNO2 |
|---|---|
| Molecular Weight | 193.13 g/mol |
| LogP | 2.08768 |
| Topological Polar Surface Area | 42.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.12741 |
| Heavy Atoms | 14 |
| Complexity | 285.73407 |
Chemical Identifiers
| CAS Number | 219489-15-3 |
|---|---|
| SMILES | B1(OC(C(O1)(C)C)(C)C)/C=C(/C)\C#N |
Product Overview
(Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile (CAS 219489-15-3), with molecular formula C10H16BNO2 and molecular weight 193.13 g/mol. IUPAC: (Z)-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enenitrile.
Chemical Property Profile of (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile
Property Insights of (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile
The XLogP value of 2.08768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile. With a topological polar surface area (TPSA) of 42.25 Ų, (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile 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 (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile?
The CAS number of (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile is 219489-15-3.
What is the molecular formula of (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile?
The molecular formula of (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile is C10H16BNO2.
What is the molecular weight of (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile?
The molecular weight of (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile is 193.13 g/mol.
Where can I buy (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile?
You can request a quote for (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.