2-Phenylpropanal
TL;DR: 2-Phenylpropanal (CAS 93-53-8) is a chemical compound with molecular formula C9H10O and molecular weight 134.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylpropanal
Also Known As: 2-Phenylpropanal, Hydratropaldehyde, 2-Phenylpropionaldehyde, Hyacinthal, Cumene aldehyde
| Molecular Formula | C9H10O |
|---|---|
| Molecular Weight | 134.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.07317 |
| Heavy Atoms | 10 |
| Complexity | 103.0 |
| Boiling Point | 92.00 to 94.00 °C. @ 12.00 mm Hg |
| Density | 0.998-1.006 |
| Solubility | Soluble in most fixed oils; Slightly soluble in propylene glycol; Insoluble in glycerin |
| Refractive Index | 1.515-1.520 |
Chemical Identifiers
| CAS Number | 93-53-8 |
|---|---|
| SMILES | CC(C=O)C1=CC=CC=C1 |
| InChIKey | IQVAERDLDAZARL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phenylpropanal (CAS 93-53-8), with molecular formula C9H10O and molecular weight 134.07 g/mol. IUPAC: 2-phenylpropanal.
Chemical Property Profile of 2-Phenylpropanal
Property Insights of 2-Phenylpropanal
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenylpropanal. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Phenylpropanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenylpropanal has 0 hydrogen bond donor(s) and 1 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-Phenylpropanal?
The CAS number of 2-Phenylpropanal is 93-53-8.
What is the molecular formula of 2-Phenylpropanal?
The molecular formula of 2-Phenylpropanal is C9H10O.
What is the molecular weight of 2-Phenylpropanal?
The molecular weight of 2-Phenylpropanal is 134.07 g/mol.
Where can I buy 2-Phenylpropanal?
You can request a quote for 2-Phenylpropanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenylpropanal?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenylpropanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.