2-(Propan-2-yl)benzaldehyde
TL;DR: 2-(Propan-2-yl)benzaldehyde (CAS 55012-32-3) is a chemical compound with molecular formula C10H12O and molecular weight 148.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-ylbenzaldehyde
Also Known As: 2-Isopropylbenzaldehyde, 2-iso-propylbenzaldehyde, Isopropylbenzaldehyde, 2-(Propan-2-Yl)Benzaldehyde, 2-propan-2-ylbenzaldehyde
| Molecular Formula | C10H12O |
|---|---|
| Molecular Weight | 148.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 148.08882 |
| Heavy Atoms | 11 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 55012-32-3 |
|---|---|
| SMILES | CC(C)C1=CC=CC=C1C=O |
| InChIKey | DTALCVXXATYTQJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Propan-2-yl)benzaldehyde (CAS 55012-32-3), with molecular formula C10H12O and molecular weight 148.09 g/mol. IUPAC: 2-propan-2-ylbenzaldehyde.
Chemical Property Profile of 2-(Propan-2-yl)benzaldehyde
Property Insights of 2-(Propan-2-yl)benzaldehyde
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Propan-2-yl)benzaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, 2-(Propan-2-yl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Propan-2-yl)benzaldehyde 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 2-(Propan-2-yl)benzaldehyde?
The CAS number of 2-(Propan-2-yl)benzaldehyde is 55012-32-3.
What is the molecular formula of 2-(Propan-2-yl)benzaldehyde?
The molecular formula of 2-(Propan-2-yl)benzaldehyde is C10H12O.
What is the molecular weight of 2-(Propan-2-yl)benzaldehyde?
The molecular weight of 2-(Propan-2-yl)benzaldehyde is 148.09 g/mol.
Where can I buy 2-(Propan-2-yl)benzaldehyde?
You can request a quote for 2-(Propan-2-yl)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Propan-2-yl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(Propan-2-yl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.