2-(2-Methyloxiran-2-yl)acetonitrile
TL;DR: 2-(2-Methyloxiran-2-yl)acetonitrile (CAS 68875-08-1) is a chemical compound with molecular formula C5H7NO and molecular weight 97.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyloxiran-2-yl)acetonitrile
Also Known As: 2-(2-methyloxiran-2-yl)acetonitrile, 2-(2-Methyloxiranyl)acetonitrile, (2-Methyloxiran-2-yl)acetonitrile, 2-OXIRANEACETONITRILE,2-METHYL-, J1.433.637K
| Molecular Formula | C5H7NO |
|---|---|
| Molecular Weight | 97.05 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 97.052765 |
| Heavy Atoms | 7 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 68875-08-1 |
|---|---|
| SMILES | CC1(CO1)CC#N |
| InChIKey | IYVDQUHIKHWXET-UHFFFAOYSA-N |
Product Overview
2-(2-Methyloxiran-2-yl)acetonitrile (CAS 68875-08-1), with molecular formula C5H7NO and molecular weight 97.05 g/mol. IUPAC: 2-(2-methyloxiran-2-yl)acetonitrile.
Chemical Property Profile of 2-(2-Methyloxiran-2-yl)acetonitrile
Property Insights of 2-(2-Methyloxiran-2-yl)acetonitrile
The XLogP value of -0.2 indicates that 2-(2-Methyloxiran-2-yl)acetonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.3 Ų, 2-(2-Methyloxiran-2-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methyloxiran-2-yl)acetonitrile 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 2-(2-Methyloxiran-2-yl)acetonitrile?
The CAS number of 2-(2-Methyloxiran-2-yl)acetonitrile is 68875-08-1.
What is the molecular formula of 2-(2-Methyloxiran-2-yl)acetonitrile?
The molecular formula of 2-(2-Methyloxiran-2-yl)acetonitrile is C5H7NO.
What is the molecular weight of 2-(2-Methyloxiran-2-yl)acetonitrile?
The molecular weight of 2-(2-Methyloxiran-2-yl)acetonitrile is 97.05 g/mol.
Where can I buy 2-(2-Methyloxiran-2-yl)acetonitrile?
You can request a quote for 2-(2-Methyloxiran-2-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methyloxiran-2-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methyloxiran-2-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.