Ar-isopropylphenylacetaldehyde
TL;DR: Ar-isopropylphenylacetaldehyde (CAS 1335-44-0) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-propan-2-ylphenyl)acetaldehyde
Also Known As: ar-Isopropylphenylacetaldehyde, Cuminacetaldehyde, Acetaldehyde, cumenyl-, m-cymene-7-carboxaldehyde, 2-(3-propan-2-ylphenyl)acetaldehyde
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 1335-44-0 |
|---|---|
| SMILES | CC(C)C1=CC=CC(=C1)CC=O |
| InChIKey | PLBFBQRBPDVZMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ar-isopropylphenylacetaldehyde (CAS 1335-44-0), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 2-(3-propan-2-ylphenyl)acetaldehyde.
Chemical Property Profile of Ar-isopropylphenylacetaldehyde
Property Insights of Ar-isopropylphenylacetaldehyde
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ar-isopropylphenylacetaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, Ar-isopropylphenylacetaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ar-isopropylphenylacetaldehyde 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
Frequently Asked Questions
What is the CAS number of Ar-isopropylphenylacetaldehyde?
The CAS number of Ar-isopropylphenylacetaldehyde is 1335-44-0.
What is the molecular formula of Ar-isopropylphenylacetaldehyde?
The molecular formula of Ar-isopropylphenylacetaldehyde is C11H14O.
What is the molecular weight of Ar-isopropylphenylacetaldehyde?
The molecular weight of Ar-isopropylphenylacetaldehyde is 162.10 g/mol.
Where can I buy Ar-isopropylphenylacetaldehyde?
You can request a quote for Ar-isopropylphenylacetaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ar-isopropylphenylacetaldehyde?
Yes, KEHONG BIO provides custom synthesis services for Ar-isopropylphenylacetaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.