Phenethyl anthranilate
TL;DR: Phenethyl anthranilate (CAS 133-18-6) is a chemical compound with molecular formula C15H15NO2 and molecular weight 241.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenylethyl 2-aminobenzoate
Also Known As: PHENETHYL ANTHRANILATE, 2-Phenylethyl 2-aminobenzoate, Phenylethyl anthranilate, 2-Phenylethyl anthranilate, Benzylcarbinyl anthranilate
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H15NO2 |
| Molecular Weight | 241.11028 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 241.11028 Da |
| Heavy Atoms | 18 |
| Complexity | 261.0 |
| Melting Point | 42 °C |
| Density | 1.14 at 77 °F (NTP, 1992) - Denser than water; will sink |
| Solubility | Insoluble (<1 mg/ml at 68.0 °F) (NTP, 1992) |
| SMILES | C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2N |
| InChIKey | PXWNBAGCFUDYBE-UHFFFAOYSA-N |
Product Description
Applications: Phenethyl anthranilate is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Phenethyl anthranilate is a pharmaceutical intermediate identified by CAS number 133-18-6 and the molecular formula C15H15NO2 and a molecular weight of 241.11 g/mol. Physically, the compound has a density of 1.14 at 77 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: Insoluble (<1 mg/ml at 68.0 °F) (NTP, 1992). Synonyms include PHENETHYL ANTHRANILATE and 2-Phenylethyl 2-aminobenzoate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Phenethyl anthranilate
Property Insights of Phenethyl anthranilate
The XLogP value of 4.2 indicates that Phenethyl anthranilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Phenethyl anthranilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethyl anthranilate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenethyl anthranilate?
The CAS number of Phenethyl anthranilate is 133-18-6.
What is the molecular formula of Phenethyl anthranilate?
The molecular formula of Phenethyl anthranilate is C15H15NO2.
What is the molecular weight of Phenethyl anthranilate?
The molecular weight of Phenethyl anthranilate is 241.11028 g/mol.
What are the applications of Phenethyl anthranilate?
Phenethyl anthranilate is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Phenethyl anthranilate?
You can request a quote for Phenethyl anthranilate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenethyl anthranilate?
Yes, CoreyChem provides custom synthesis services for Phenethyl anthranilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.