2-Propanone, 1,1-diethoxy-3-phenyl-
TL;DR: 2-Propanone, 1,1-diethoxy-3-phenyl- (CAS 19256-31-6) is a chemical compound with molecular formula C13H18O3 and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-diethoxy-3-phenylpropan-2-one
Also Known As: 1,1-diethoxy-3-phenylpropan-2-one, 1,1-Diethoxy-3-phenylacetone, 2-Propanone, 1,1-diethoxy-3-phenyl-, 2-Propanone,1,1-diethoxy-3-phenyl-, 3-Phenylpyruvaldehyde diethyl acetal
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 19256-31-6 |
|---|---|
| SMILES | CCOC(C(=O)CC1=CC=CC=C1)OCC |
| InChIKey | LFYMGSKZVOVUKZ-UHFFFAOYSA-N |
Product Overview
2-Propanone, 1,1-diethoxy-3-phenyl- (CAS 19256-31-6), with molecular formula C13H18O3 and molecular weight 222.13 g/mol. IUPAC: 1,1-diethoxy-3-phenylpropan-2-one.
Chemical Property Profile of 2-Propanone, 1,1-diethoxy-3-phenyl-
Property Insights of 2-Propanone, 1,1-diethoxy-3-phenyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanone, 1,1-diethoxy-3-phenyl-. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Propanone, 1,1-diethoxy-3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanone, 1,1-diethoxy-3-phenyl- 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-Propanone, 1,1-diethoxy-3-phenyl-?
The CAS number of 2-Propanone, 1,1-diethoxy-3-phenyl- is 19256-31-6.
What is the molecular formula of 2-Propanone, 1,1-diethoxy-3-phenyl-?
The molecular formula of 2-Propanone, 1,1-diethoxy-3-phenyl- is C13H18O3.
What is the molecular weight of 2-Propanone, 1,1-diethoxy-3-phenyl-?
The molecular weight of 2-Propanone, 1,1-diethoxy-3-phenyl- is 222.13 g/mol.
Where can I buy 2-Propanone, 1,1-diethoxy-3-phenyl-?
You can request a quote for 2-Propanone, 1,1-diethoxy-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanone, 1,1-diethoxy-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanone, 1,1-diethoxy-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.