3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde
TL;DR: 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde (CAS 311328-84-4) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-5-hydroxy-5-phenyl-4H-pyrazole-1-carbaldehyde
Also Known As: 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde, BAS 00630983, 1-Formyl-3-ethyl-5-phenyl-5-hydroxy-2-pyrazoline, 3-ethyl-5-hydroxy-5-phenyl-4H-pyrazole-1-carbaldehyde, 3-ethyl-5-hydroxy-5-phenyl-2-pyrazolinecarbaldehyde
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 311328-84-4 |
|---|---|
| SMILES | CCC1=NN(C(C1)(C2=CC=CC=C2)O)C=O |
| InChIKey | IRJAMZSJCOJQAE-UHFFFAOYSA-N |
Product Overview
3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde (CAS 311328-84-4), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 3-ethyl-5-hydroxy-5-phenyl-4H-pyrazole-1-carbaldehyde.
Chemical Property Profile of 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde
Property Insights of 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde. With a topological polar surface area (TPSA) of 52.9 Ų, 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde has 1 hydrogen bond donor(s) and 3 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-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
The CAS number of 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde is 311328-84-4.
What is the molecular formula of 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
The molecular formula of 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde is C12H14N2O2.
What is the molecular weight of 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
The molecular weight of 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde is 218.11 g/mol.
Where can I buy 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
You can request a quote for 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-5-hydroxy-5-phenyl-4,5-dihydro-1H-pyrazole-1-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.