1-Chloro-1,2-dihydroacenaphthylene
TL;DR: 1-Chloro-1,2-dihydroacenaphthylene (CAS 40745-49-1) is a chemical compound with molecular formula C12H9Cl and molecular weight 188.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-1,2-dihydroacenaphthylene
Also Known As: 1-chloroacenaphthene, Acenaphthene, 1-chloro, 1-chloro-1,2-dihydroacenaphthylene, 5-methyl-1-(4-methylphenyl)-1H-tetrazole
| Molecular Formula | C12H9Cl |
|---|---|
| Molecular Weight | 188.04 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.03928 |
| Heavy Atoms | 13 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 40745-49-1 |
|---|---|
| SMILES | C1C(C2=CC=CC3=C2C1=CC=C3)Cl |
| InChIKey | ANIXIIYQBGBGRI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-1,2-dihydroacenaphthylene (CAS 40745-49-1), with molecular formula C12H9Cl and molecular weight 188.04 g/mol. IUPAC: 1-chloro-1,2-dihydroacenaphthylene.
Chemical Property Profile of 1-Chloro-1,2-dihydroacenaphthylene
Property Insights of 1-Chloro-1,2-dihydroacenaphthylene
The XLogP value of 3.6 indicates that 1-Chloro-1,2-dihydroacenaphthylene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chloro-1,2-dihydroacenaphthylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-1,2-dihydroacenaphthylene has 0 hydrogen bond donor(s) and 0 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-Chloro-1,2-dihydroacenaphthylene?
The CAS number of 1-Chloro-1,2-dihydroacenaphthylene is 40745-49-1.
What is the molecular formula of 1-Chloro-1,2-dihydroacenaphthylene?
The molecular formula of 1-Chloro-1,2-dihydroacenaphthylene is C12H9Cl.
What is the molecular weight of 1-Chloro-1,2-dihydroacenaphthylene?
The molecular weight of 1-Chloro-1,2-dihydroacenaphthylene is 188.04 g/mol.
Where can I buy 1-Chloro-1,2-dihydroacenaphthylene?
You can request a quote for 1-Chloro-1,2-dihydroacenaphthylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-1,2-dihydroacenaphthylene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-1,2-dihydroacenaphthylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.