Benzene, 1-methyl-3-(2-phenylethyl)-
TL;DR: Benzene, 1-methyl-3-(2-phenylethyl)- (CAS 34403-06-0) is a chemical compound with molecular formula C15H16 and molecular weight 196.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-(2-phenylethyl)benzene
Also Known As: 3-Phenethyltoluene, 1-methyl-3-(2-phenylethyl)benzene, 1-methyl-3-phenethylbenzene, 1-Phenyl-2- ethane, Benzene, 1-methyl-3-(2-phenylethyl)-
| Molecular Formula | C15H16 |
|---|---|
| Molecular Weight | 196.13 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.1252 |
| Heavy Atoms | 15 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 34403-06-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CCC2=CC=CC=C2 |
| InChIKey | ZWRSMFOUGMXCNP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-methyl-3-(2-phenylethyl)- (CAS 34403-06-0), with molecular formula C15H16 and molecular weight 196.13 g/mol. IUPAC: 1-methyl-3-(2-phenylethyl)benzene.
Chemical Property Profile of Benzene, 1-methyl-3-(2-phenylethyl)-
Property Insights of Benzene, 1-methyl-3-(2-phenylethyl)-
The XLogP value of 5.2 indicates that Benzene, 1-methyl-3-(2-phenylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1-methyl-3-(2-phenylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-methyl-3-(2-phenylethyl)- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1-methyl-3-(2-phenylethyl)-?
The CAS number of Benzene, 1-methyl-3-(2-phenylethyl)- is 34403-06-0.
What is the molecular formula of Benzene, 1-methyl-3-(2-phenylethyl)-?
The molecular formula of Benzene, 1-methyl-3-(2-phenylethyl)- is C15H16.
What is the molecular weight of Benzene, 1-methyl-3-(2-phenylethyl)-?
The molecular weight of Benzene, 1-methyl-3-(2-phenylethyl)- is 196.13 g/mol.
Where can I buy Benzene, 1-methyl-3-(2-phenylethyl)-?
You can request a quote for Benzene, 1-methyl-3-(2-phenylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-methyl-3-(2-phenylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-methyl-3-(2-phenylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.