Phenanthrene, 9-(chloromethyl)-
TL;DR: Phenanthrene, 9-(chloromethyl)- (CAS 951-05-3) is a chemical compound with molecular formula C15H11Cl and molecular weight 226.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(chloromethyl)phenanthrene
Also Known As: 9-(Chloromethyl)phenanthrene, 9-CHLOROMETHYLPHENANTHRENE, Phenanthrene, 9-(chloromethyl)-, 9-(chloromethyl)-phenanthrene, NCIOpen2_004303
| Molecular Formula | C15H11Cl |
|---|---|
| Molecular Weight | 226.05 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.05493 |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 951-05-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)CCl |
| InChIKey | SYNQYTBSQNSROF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenanthrene, 9-(chloromethyl)- (CAS 951-05-3), with molecular formula C15H11Cl and molecular weight 226.05 g/mol. IUPAC: 9-(chloromethyl)phenanthrene.
Chemical Property Profile of Phenanthrene, 9-(chloromethyl)-
Property Insights of Phenanthrene, 9-(chloromethyl)-
The XLogP value of 4.8 indicates that Phenanthrene, 9-(chloromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Phenanthrene, 9-(chloromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenanthrene, 9-(chloromethyl)- 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 Phenanthrene, 9-(chloromethyl)-?
The CAS number of Phenanthrene, 9-(chloromethyl)- is 951-05-3.
What is the molecular formula of Phenanthrene, 9-(chloromethyl)-?
The molecular formula of Phenanthrene, 9-(chloromethyl)- is C15H11Cl.
What is the molecular weight of Phenanthrene, 9-(chloromethyl)-?
The molecular weight of Phenanthrene, 9-(chloromethyl)- is 226.05 g/mol.
Where can I buy Phenanthrene, 9-(chloromethyl)-?
You can request a quote for Phenanthrene, 9-(chloromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenanthrene, 9-(chloromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenanthrene, 9-(chloromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.