![2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one structure](/static/products/6604/66045-90-7.webp)
2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one
TL;DR: 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one (CAS 66045-90-7) is a chemical compound with molecular formula C17H13BrO and molecular weight 312.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one
Also Known As: 2-[(4-bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one, (2E)-2-[(4-bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one
| Molecular Formula | C17H13BrO |
|---|---|
| Molecular Weight | 312.01 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 312.01498 |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 66045-90-7 |
|---|---|
| SMILES | C1CC(=CC2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C31 |
| InChIKey | MWRVIWQRUAVGJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one (CAS 66045-90-7), with molecular formula C17H13BrO and molecular weight 312.01 g/mol. IUPAC: 2-[(4-bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one
Property Insights of 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one
The XLogP value of 4.8 indicates that 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one has 0 hydrogen bond donor(s) and 1 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-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one?
The CAS number of 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one is 66045-90-7.
What is the molecular formula of 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one?
The molecular formula of 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one is C17H13BrO.
What is the molecular weight of 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one?
The molecular weight of 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one is 312.01 g/mol.
Where can I buy 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one?
You can request a quote for 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Bromophenyl)methylidene]-3,4-dihydronaphthalen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.