![2-[Hydroxy(diphenyl)methyl]butanenitrile structure](/static/products/2210/22101-20-8.webp)
2-[Hydroxy(diphenyl)methyl]butanenitrile
TL;DR: 2-[Hydroxy(diphenyl)methyl]butanenitrile (CAS 22101-20-8) is a chemical compound with molecular formula C17H17NO and molecular weight 251.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[hydroxy(diphenyl)methyl]butanenitrile
Also Known As: 2- butyronitrile, 2-[hydroxy(diphenyl)methyl]butanenitrile, 2-cyano-5,6-dihydro-1,4-dioxin, 2-(alpha-Hydroxybenzhydryl)butyronitrile, 2-(HYDROXYDIPHENYLMETHYL)BUTANENITRILE
| Molecular Formula | C17H17NO |
|---|---|
| Molecular Weight | 251.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.13101 |
| Heavy Atoms | 19 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 22101-20-8 |
|---|---|
| SMILES | CCC(C#N)C(C1=CC=CC=C1)(C2=CC=CC=C2)O |
| InChIKey | ZDTPCZLGZKXXGW-UHFFFAOYSA-N |
Product Overview
2-[Hydroxy(diphenyl)methyl]butanenitrile (CAS 22101-20-8), with molecular formula C17H17NO and molecular weight 251.13 g/mol. IUPAC: 2-[hydroxy(diphenyl)methyl]butanenitrile.
Chemical Property Profile of 2-[Hydroxy(diphenyl)methyl]butanenitrile
Property Insights of 2-[Hydroxy(diphenyl)methyl]butanenitrile
The XLogP value of 3.2 indicates that 2-[Hydroxy(diphenyl)methyl]butanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.0 Ų, 2-[Hydroxy(diphenyl)methyl]butanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Hydroxy(diphenyl)methyl]butanenitrile 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
Frequently Asked Questions
What is the CAS number of 2-[Hydroxy(diphenyl)methyl]butanenitrile?
The CAS number of 2-[Hydroxy(diphenyl)methyl]butanenitrile is 22101-20-8.
What is the molecular formula of 2-[Hydroxy(diphenyl)methyl]butanenitrile?
The molecular formula of 2-[Hydroxy(diphenyl)methyl]butanenitrile is C17H17NO.
What is the molecular weight of 2-[Hydroxy(diphenyl)methyl]butanenitrile?
The molecular weight of 2-[Hydroxy(diphenyl)methyl]butanenitrile is 251.13 g/mol.
Where can I buy 2-[Hydroxy(diphenyl)methyl]butanenitrile?
You can request a quote for 2-[Hydroxy(diphenyl)methyl]butanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Hydroxy(diphenyl)methyl]butanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[Hydroxy(diphenyl)methyl]butanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.