Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-
TL;DR: Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- (CAS 20862-56-0) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxyphenyl)-1-pyrrolidin-1-ylpropan-1-one
Also Known As: 2-vinylnaphthalene oxide, Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-, 1-(o-Hydroxyhydrocinnamoyl)pyrrolidine, beta-(o-Hydroxyphenyl)propionyl pyrrolidide, 3-(2-hydroxyphenyl)-1-pyrrolidin-1-ylpropan-1-one
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 20862-56-0 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CCC2=CC=CC=C2O |
| InChIKey | YKUGADFHBPXKFO-UHFFFAOYSA-N |
Product Overview
Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- (CAS 20862-56-0), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 3-(2-hydroxyphenyl)-1-pyrrolidin-1-ylpropan-1-one.
Chemical Property Profile of Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-
Property Insights of Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-. With a topological polar surface area (TPSA) of 40.5 Ų, Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- 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 Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-?
The CAS number of Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- is 20862-56-0.
What is the molecular formula of Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-?
The molecular formula of Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- is C13H17NO2.
What is the molecular weight of Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-?
The molecular weight of Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- is 219.13 g/mol.
Where can I buy Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-?
You can request a quote for Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-(o-hydroxyhydrocinnamoyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.