3-p-Isopropylphenyl-3-methylpropanal
TL;DR: 3-p-Isopropylphenyl-3-methylpropanal (CAS 103-95-7) is a chemical compound with molecular formula C13H18O and molecular weight 190.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-propan-2-ylphenyl)butanal
Also Known As: Cyclamal, Cyclamen aldehyde, 3-(4-propan-2-ylphenyl)butanal, 3-(4-Isopropylphenyl)isobutyraldehyde, 3-[4-(propan-2-yl)phenyl]butanal
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H18O |
| Molecular Weight | 190.13577 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 190.13577 Da |
| Heavy Atoms | 14 |
| Complexity | 166.0 |
| SMILES | CC(C)C1=CC=C(C=C1)C(C)CC=O |
| InChIKey | HQQPOVNESMNPNH-UHFFFAOYSA-N |
Product Description
Applications: 3-p-Isopropylphenyl-3-methylpropanal is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3-p-Isopropylphenyl-3-methylpropanal (CAS 103-95-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
3-p-Isopropylphenyl-3-methylpropanal is a heterocyclic building block identified by CAS number 103-95-7 and the molecular formula C13H18O and a molecular weight of 190.14 g/mol. It is also known as Cyclamal and Cyclamen aldehyde.
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 3-p-Isopropylphenyl-3-methylpropanal
Property Insights of 3-p-Isopropylphenyl-3-methylpropanal
The XLogP value of 3.1 indicates that 3-p-Isopropylphenyl-3-methylpropanal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3-p-Isopropylphenyl-3-methylpropanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-p-Isopropylphenyl-3-methylpropanal has 0 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 3-p-Isopropylphenyl-3-methylpropanal?
The CAS number of 3-p-Isopropylphenyl-3-methylpropanal is 103-95-7.
What is the molecular formula of 3-p-Isopropylphenyl-3-methylpropanal?
The molecular formula of 3-p-Isopropylphenyl-3-methylpropanal is C13H18O.
What is the molecular weight of 3-p-Isopropylphenyl-3-methylpropanal?
The molecular weight of 3-p-Isopropylphenyl-3-methylpropanal is 190.13577 g/mol.
What are the applications of 3-p-Isopropylphenyl-3-methylpropanal?
3-p-Isopropylphenyl-3-methylpropanal is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 3-p-Isopropylphenyl-3-methylpropanal?
You can request a quote for 3-p-Isopropylphenyl-3-methylpropanal directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-p-Isopropylphenyl-3-methylpropanal?
Yes, CoreyChem provides custom synthesis services for 3-p-Isopropylphenyl-3-methylpropanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.