Phenol, chloro(phenylmethyl)-
TL;DR: Phenol, chloro(phenylmethyl)- (CAS 105094-80-2) is a chemical compound with molecular formula C13H11ClO and molecular weight 218.04984 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzyl-3-chlorophenol
Also Known As: Benzyl chlorophenol, 2-benzyl-3-chlorophenol, Chlorbenzylphenol, Chloro(phenylmethyl)phenol, Phenol, chloro(phenylmethyl)-
Technical Specifications
| Molecular Formula | C13H11ClO |
| Molecular Weight | 218.04984 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.04984 Da |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
| SMILES | C1=CC=C(C=C1)CC2=C(C=CC=C2Cl)O |
| InChIKey | ZAMOVMHWSVVCQD-UHFFFAOYSA-N |
Chemical Property Profile of Phenol, chloro(phenylmethyl)-
Property Insights of Phenol, chloro(phenylmethyl)-
The XLogP value of 4.1 indicates that Phenol, chloro(phenylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Phenol, chloro(phenylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, chloro(phenylmethyl)- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenol, chloro(phenylmethyl)-?
The CAS number of Phenol, chloro(phenylmethyl)- is 105094-80-2.
What is the molecular formula of Phenol, chloro(phenylmethyl)-?
The molecular formula of Phenol, chloro(phenylmethyl)- is C13H11ClO.
What is the molecular weight of Phenol, chloro(phenylmethyl)-?
The molecular weight of Phenol, chloro(phenylmethyl)- is 218.04984 g/mol.
Where can I buy Phenol, chloro(phenylmethyl)-?
You can request a quote for Phenol, chloro(phenylmethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenol, chloro(phenylmethyl)-?
Yes, CoreyChem provides custom synthesis services for Phenol, chloro(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.