1-(Hydroxymethyl)cyclopropaneacetonitrile
TL;DR: 1-(Hydroxymethyl)cyclopropaneacetonitrile (CAS 152922-71-9) is a chemical compound with molecular formula C6H9NO and molecular weight 111.06841 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-(hydroxymethyl)cyclopropyl]acetonitrile
Also Known As: 1-(Hydroxymethyl)cyclopropaneacetonitrile, 2-(1-(Hydroxymethyl)cyclopropyl)acetonitrile, 2-[1-(hydroxymethyl)cyclopropyl]acetonitrile, Montelukast Impurity 53, [1-(Hydroxymethyl)cyclopropyl]acetonitrile
Technical Specifications
| Molecular Formula | C6H9NO |
| Molecular Weight | 111.06841 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 111.06841 Da |
| Heavy Atoms | 8 |
| Complexity | 129.0 |
| SMILES | C1CC1(CC#N)CO |
| InChIKey | WYOMLUMUVAPMKE-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Hydroxymethyl)cyclopropaneacetonitrile
Property Insights of 1-(Hydroxymethyl)cyclopropaneacetonitrile
The XLogP value of -0.2 indicates that 1-(Hydroxymethyl)cyclopropaneacetonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.0 Ų, 1-(Hydroxymethyl)cyclopropaneacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Hydroxymethyl)cyclopropaneacetonitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(Hydroxymethyl)cyclopropaneacetonitrile?
The CAS number of 1-(Hydroxymethyl)cyclopropaneacetonitrile is 152922-71-9.
What is the molecular formula of 1-(Hydroxymethyl)cyclopropaneacetonitrile?
The molecular formula of 1-(Hydroxymethyl)cyclopropaneacetonitrile is C6H9NO.
What is the molecular weight of 1-(Hydroxymethyl)cyclopropaneacetonitrile?
The molecular weight of 1-(Hydroxymethyl)cyclopropaneacetonitrile is 111.06841 g/mol.
Where can I buy 1-(Hydroxymethyl)cyclopropaneacetonitrile?
You can request a quote for 1-(Hydroxymethyl)cyclopropaneacetonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Hydroxymethyl)cyclopropaneacetonitrile?
Yes, CoreyChem provides custom synthesis services for 1-(Hydroxymethyl)cyclopropaneacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.