C17H13ClO
TL;DR: C17H13ClO (CAS 59082-35-8) is a chemical compound with molecular formula C17H13ClO and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methylidene]-3,4-dihydronaphthalen-1-one
Also Known As: Maybridge1_007337, 2-(4-Chlorophenylmethylene)-1-tetralone, 2-[(4-chlorophenyl)methylene]tetralin-1-one, (E)-3,4-Dihydro-2-((4-chlorophenyl)methylene)-1(2H)-naphthalenone, (2E)-2-[(4-chlorophenyl)methylidene]-3,4-dihydronaphthalen-1
| Molecular Formula | C17H13ClO |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.0655 |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 59082-35-8 |
|---|---|
| SMILES | C1CC(=CC2=CC=C(C=C2)Cl)C(=O)C3=CC=CC=C31 |
| InChIKey | OWFGMURBYHPNJK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
C17H13ClO (CAS 59082-35-8), with molecular formula C17H13ClO and molecular weight 268.07 g/mol. IUPAC: 2-[(4-chlorophenyl)methylidene]-3,4-dihydronaphthalen-1-one.
Chemical Property Profile of C17H13ClO
Property Insights of C17H13ClO
The XLogP value of 4.7 indicates that C17H13ClO is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, C17H13ClO exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C17H13ClO 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 C17H13ClO?
The CAS number of C17H13ClO is 59082-35-8.
What is the molecular formula of C17H13ClO?
The molecular formula of C17H13ClO is C17H13ClO.
What is the molecular weight of C17H13ClO?
The molecular weight of C17H13ClO is 268.07 g/mol.
Where can I buy C17H13ClO?
You can request a quote for C17H13ClO directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H13ClO?
Yes, KEHONG BIO provides custom synthesis services for C17H13ClO and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.