1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate
TL;DR: 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate (CAS 113090-50-9) is a chemical compound with molecular formula C20H16O3 and molecular weight 304.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-oxo-1-phenylpropan-2-yl) naphthalene-1-carboxylate
Also Known As: J3.346.867I, 1-oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate, 1-Methyl-2-oxo-2-phenylethyl 1-naphthalenecarboxylate, (1-oxo-1-phenylpropan-2-yl) naphthalene-1-carboxylate, Naphthalene-1-carboxylic acid alpha-methyl-beta-oxophenethyl ester
| Molecular Formula | C20H16O3 |
|---|---|
| Molecular Weight | 304.11 g/mol |
| LogP | 4.268 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.10995 |
| Heavy Atoms | 23 |
| Complexity | 847.6545 |
Chemical Identifiers
| CAS Number | 113090-50-9 |
|---|---|
| SMILES | CC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC3=CC=CC=C32 |
Product Overview
1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate (CAS 113090-50-9), with molecular formula C20H16O3 and molecular weight 304.11 g/mol. IUPAC: (1-oxo-1-phenylpropan-2-yl) naphthalene-1-carboxylate.
Chemical Property Profile of 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate
Property Insights of 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate
The XLogP value of 4.268 indicates that 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate 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 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate?
The CAS number of 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate is 113090-50-9.
What is the molecular formula of 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate?
The molecular formula of 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate is C20H16O3.
What is the molecular weight of 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate?
The molecular weight of 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate is 304.11 g/mol.
Where can I buy 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate?
You can request a quote for 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Oxo-1-phenylpropan-2-yl naphthalene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.