2,2-Diethoxyacetophenone
TL;DR: 2,2-Diethoxyacetophenone (CAS 6175-45-7) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-diethoxy-1-phenylethanone
Also Known As: 2,2-Diethoxyacetophenone, 2,2-Diethoxy-1-phenylethanone, Phenylglyoxal diethyl acetal, Ethanone, 2,2-diethoxy-1-phenyl-, DEAP
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 6175-45-7 |
|---|---|
| SMILES | CCOC(C(=O)C1=CC=CC=C1)OCC |
| InChIKey | PIZHFBODNLEQBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Diethoxyacetophenone (CAS 6175-45-7), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 2,2-diethoxy-1-phenylethanone.
Chemical Property Profile of 2,2-Diethoxyacetophenone
Property Insights of 2,2-Diethoxyacetophenone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Diethoxyacetophenone. With a topological polar surface area (TPSA) of 35.5 Ų, 2,2-Diethoxyacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Diethoxyacetophenone has 0 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 2,2-Diethoxyacetophenone?
The CAS number of 2,2-Diethoxyacetophenone is 6175-45-7.
What is the molecular formula of 2,2-Diethoxyacetophenone?
The molecular formula of 2,2-Diethoxyacetophenone is C12H16O3.
What is the molecular weight of 2,2-Diethoxyacetophenone?
The molecular weight of 2,2-Diethoxyacetophenone is 208.11 g/mol.
Where can I buy 2,2-Diethoxyacetophenone?
You can request a quote for 2,2-Diethoxyacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Diethoxyacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Diethoxyacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.