methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate
TL;DR: methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate (CAS 2962-67-6) is a chemical compound with molecular formula C18H16O3 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate
Also Known As: methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate, Methyl 4-oxo-1-phenyl-1,2,3,4-tetrahydronaphthalene-2-carboxylate, 2-Naphthalenecarboxylicacid, 1,2,3,4-tetrahydro-4-oxo-1-phenyl-, methyl ester
| Molecular Formula | C18H16O3 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.10995 |
| Heavy Atoms | 21 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 2962-67-6 |
|---|---|
| SMILES | COC(=O)C1CC(=O)C2=CC=CC=C2C1C3=CC=CC=C3 |
| InChIKey | RBIHASBAKDZTHP-UHFFFAOYSA-N |
Product Overview
methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate (CAS 2962-67-6), with molecular formula C18H16O3 and molecular weight 280.11 g/mol. IUPAC: methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate.
Chemical Property Profile of methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate
Property Insights of methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate
The XLogP value of 3.0 indicates that methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-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 methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate?
The CAS number of methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate is 2962-67-6.
What is the molecular formula of methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate?
The molecular formula of methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate is C18H16O3.
What is the molecular weight of methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate?
The molecular weight of methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate is 280.11 g/mol.
Where can I buy methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate?
You can request a quote for methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-oxo-1-phenyl-2,3-dihydro-1H-naphthalene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.