2,3-Dimethyl-3-phenylpropionaldehyde
TL;DR: 2,3-Dimethyl-3-phenylpropionaldehyde (CAS 97416-75-6) 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-methyl-3-phenylbutanal
Also Known As: 2-methyl-3-phenylbutanal, 2,3-Dimethyl-3-phenylpropionaldehyde, EINECS 306-822-9, alpha,beta-Dimethylbenzenepropanal, 2,3-dimethyl-3-phenylpropanaldehyde
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 2.6251 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 240.44084 |
Chemical Identifiers
| CAS Number | 97416-75-6 |
|---|---|
| SMILES | CC(C=O)C(C)C1=CC=CC=C1 |
Product Overview
2,3-Dimethyl-3-phenylpropionaldehyde (CAS 97416-75-6), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 2-methyl-3-phenylbutanal.
Chemical Property Profile of 2,3-Dimethyl-3-phenylpropionaldehyde
Property Insights of 2,3-Dimethyl-3-phenylpropionaldehyde
The XLogP value of 2.6251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dimethyl-3-phenylpropionaldehyde. With a topological polar surface area (TPSA) of 17.07 Ų, 2,3-Dimethyl-3-phenylpropionaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethyl-3-phenylpropionaldehyde 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 2,3-Dimethyl-3-phenylpropionaldehyde?
The CAS number of 2,3-Dimethyl-3-phenylpropionaldehyde is 97416-75-6.
What is the molecular formula of 2,3-Dimethyl-3-phenylpropionaldehyde?
The molecular formula of 2,3-Dimethyl-3-phenylpropionaldehyde is C11H14O.
What is the molecular weight of 2,3-Dimethyl-3-phenylpropionaldehyde?
The molecular weight of 2,3-Dimethyl-3-phenylpropionaldehyde is 162.10 g/mol.
Where can I buy 2,3-Dimethyl-3-phenylpropionaldehyde?
You can request a quote for 2,3-Dimethyl-3-phenylpropionaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethyl-3-phenylpropionaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethyl-3-phenylpropionaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.