![(2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one structure](/static/products/1090/109091-35-2.webp)
(2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one
TL;DR: (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one (CAS 109091-35-2) is a chemical compound with molecular formula C17H13NO3 and molecular weight 279.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-nitrophenyl)methylidene]-3,4-dihydronaphthalen-1-one
Also Known As: 2-(2-NITROBENZYLIDENE)-1-TETRALONE, 2-(2-nitrobenzylidene)-3,4-dihydronaphthalen-1(2H)-one, 2-[(2-nitrophenyl)methylidene]-3,4-dihydronaphthalen-1-one, (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one
| Molecular Formula | C17H13NO3 |
|---|---|
| Molecular Weight | 279.09 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.08954 |
| Heavy Atoms | 21 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 109091-35-2 |
|---|---|
| SMILES | C1CC(=CC2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=CC=C31 |
| InChIKey | SWEJFWNQBMCNKA-UHFFFAOYSA-N |
Product Overview
(2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one (CAS 109091-35-2), with molecular formula C17H13NO3 and molecular weight 279.09 g/mol. IUPAC: 2-[(2-nitrophenyl)methylidene]-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one
Property Insights of (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one
The XLogP value of 3.9 indicates that (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one. Following Lipinski's Rule of Five, (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one 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 (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one?
The CAS number of (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one is 109091-35-2.
What is the molecular formula of (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one?
The molecular formula of (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one is C17H13NO3.
What is the molecular weight of (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one?
The molecular weight of (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one is 279.09 g/mol.
Where can I buy (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one?
You can request a quote for (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[(2-nitrophenyl)methylidene]-1,2,3,4-tetrahydronaphthalen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.