3-Hydroxy-2,3,3-triphenylpropanenitrile
TL;DR: 3-Hydroxy-2,3,3-triphenylpropanenitrile (CAS 16248-67-2) is a chemical compound with molecular formula C21H17NO and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2,3,3-triphenylpropanenitrile
Also Known As: NCIOpen2_007335, 3-hydroxy-2,3,3-triphenylpropanenitrile, 2,3,3-Triphenyl-3-hydroxypropiononitrile, 3-hydroxy-2,3,3-triphenyl-propionitrile, Benzenepropanenitrile, b-hydroxy-a,b-diphenyl-
| Molecular Formula | C21H17NO |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.131 |
| Heavy Atoms | 23 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 16248-67-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C#N)C(C2=CC=CC=C2)(C3=CC=CC=C3)O |
| InChIKey | AQROMKCCQRTJFM-UHFFFAOYSA-N |
Product Overview
3-Hydroxy-2,3,3-triphenylpropanenitrile (CAS 16248-67-2), with molecular formula C21H17NO and molecular weight 299.13 g/mol. IUPAC: 3-hydroxy-2,3,3-triphenylpropanenitrile.
Chemical Property Profile of 3-Hydroxy-2,3,3-triphenylpropanenitrile
Property Insights of 3-Hydroxy-2,3,3-triphenylpropanenitrile
The XLogP value of 3.9 indicates that 3-Hydroxy-2,3,3-triphenylpropanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.0 Ų, 3-Hydroxy-2,3,3-triphenylpropanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-2,3,3-triphenylpropanenitrile 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 3-Hydroxy-2,3,3-triphenylpropanenitrile?
The CAS number of 3-Hydroxy-2,3,3-triphenylpropanenitrile is 16248-67-2.
What is the molecular formula of 3-Hydroxy-2,3,3-triphenylpropanenitrile?
The molecular formula of 3-Hydroxy-2,3,3-triphenylpropanenitrile is C21H17NO.
What is the molecular weight of 3-Hydroxy-2,3,3-triphenylpropanenitrile?
The molecular weight of 3-Hydroxy-2,3,3-triphenylpropanenitrile is 299.13 g/mol.
Where can I buy 3-Hydroxy-2,3,3-triphenylpropanenitrile?
You can request a quote for 3-Hydroxy-2,3,3-triphenylpropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-2,3,3-triphenylpropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-2,3,3-triphenylpropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.