3,5-Bis(tert-butyl)benzaldehyde
TL;DR: 3,5-Bis(tert-butyl)benzaldehyde (CAS 17610-00-3) is a chemical compound with molecular formula C15H22O and molecular weight 218.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-ditert-butylbenzaldehyde
Also Known As: 3,5-Di-tert-butylbenzaldehyde, 3,5-Bis(tert-butyl)benzaldehyde, 3,5-ditert-butylbenzaldehyde, 3,5-Di-tert-butyl-benzaldehyde, 3-Ethoxyacryloyl chloride
| Molecular Formula | C15H22O |
|---|---|
| Molecular Weight | 218.17 g/mol |
| LogP | 4.0941 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.16707 |
| Heavy Atoms | 16 |
| Complexity | 356.62646 |
Chemical Identifiers
| CAS Number | 17610-00-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1)C=O)C(C)(C)C |
Product Overview
3,5-Bis(tert-butyl)benzaldehyde (CAS 17610-00-3), with molecular formula C15H22O and molecular weight 218.17 g/mol. IUPAC: 3,5-ditert-butylbenzaldehyde.
Chemical Property Profile of 3,5-Bis(tert-butyl)benzaldehyde
Property Insights of 3,5-Bis(tert-butyl)benzaldehyde
The XLogP value of 4.0941 indicates that 3,5-Bis(tert-butyl)benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 3,5-Bis(tert-butyl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis(tert-butyl)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 3,5-Bis(tert-butyl)benzaldehyde?
The CAS number of 3,5-Bis(tert-butyl)benzaldehyde is 17610-00-3.
What is the molecular formula of 3,5-Bis(tert-butyl)benzaldehyde?
The molecular formula of 3,5-Bis(tert-butyl)benzaldehyde is C15H22O.
What is the molecular weight of 3,5-Bis(tert-butyl)benzaldehyde?
The molecular weight of 3,5-Bis(tert-butyl)benzaldehyde is 218.17 g/mol.
Where can I buy 3,5-Bis(tert-butyl)benzaldehyde?
You can request a quote for 3,5-Bis(tert-butyl)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis(tert-butyl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(tert-butyl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.