Isopropylparaben
TL;DR: Isopropylparaben (CAS 4191-73-5) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl 4-hydroxybenzoate
Also Known As: Isopropylparaben, Isopropyl 4-hydroxybenzoate, isopropyl paraben, Isopropyl p-hydroxybenzoate, propan-2-yl 4-hydroxybenzoate
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12O3 |
| Molecular Weight | 180.07864 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.07864 Da |
| Heavy Atoms | 13 |
| Complexity | 169.0 |
| SMILES | CC(C)OC(=O)C1=CC=C(C=C1)O |
| InChIKey | CMHMMKSPYOOVGI-UHFFFAOYSA-N |
Product Description
Applications: Isopropylparaben is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Isopropylparaben (CAS 4191-73-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Isopropylparaben (CAS 4191-73-5) has the molecular formula C10H12O3 and a molecular weight of 180.08 g/mol. It is also known as Isopropylparaben and Isopropyl 4-hydroxybenzoate.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Isopropylparaben
Property Insights of Isopropylparaben
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylparaben. With a topological polar surface area (TPSA) of 46.5 Ų, Isopropylparaben exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropylparaben 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 Isopropylparaben?
The CAS number of Isopropylparaben is 4191-73-5.
What is the molecular formula of Isopropylparaben?
The molecular formula of Isopropylparaben is C10H12O3.
What is the molecular weight of Isopropylparaben?
The molecular weight of Isopropylparaben is 180.07864 g/mol.
What are the applications of Isopropylparaben?
Isopropylparaben is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Isopropylparaben (CAS 4191-73-5) with custom synthesis available from...
Where can I buy Isopropylparaben?
You can request a quote for Isopropylparaben directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isopropylparaben?
Yes, CoreyChem provides custom synthesis services for Isopropylparaben and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.