3,5-二叔丁基-4-羟基苯甲醛
TL;DR: 3,5-二叔丁基-4-羟基苯甲醛 (CAS 1620-98-0) is a chemical compound with molecular formula C15H22O2 and molecular weight 234.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二叔丁基-4-羟基苯甲醛
3,5-ditert-butyl-4-hydroxybenzaldehyde
Also Known As: 3,5-Di-tert-butyl-4-hydroxybenzaldehyde, BHT-CHO, 3,5-ditert-butyl-4-hydroxybenzaldehyde, BHT-OCH, Benzaldehyde, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-
| Molecular Formula | C15H22O2 |
|---|---|
| Molecular Weight | 234.16 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.16199 |
| Heavy Atoms | 17 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 1620-98-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=O |
| InChIKey | DOZRDZLFLOODMB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二叔丁基-4-羟基苯甲醛 (CAS 1620-98-0), with molecular formula C15H22O2 and molecular weight 234.16 g/mol. IUPAC: 3,5-ditert-butyl-4-hydroxybenzaldehyde.
Chemical Property Profile of 3,5-二叔丁基-4-羟基苯甲醛
Property Insights of 3,5-二叔丁基-4-羟基苯甲醛
The XLogP value of 4.4 indicates that 3,5-二叔丁基-4-羟基苯甲醛 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3,5-二叔丁基-4-羟基苯甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-二叔丁基-4-羟基苯甲醛 has 1 hydrogen bond donor(s) and 2 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 3,5-二叔丁基-4-羟基苯甲醛?
The CAS number of 3,5-二叔丁基-4-羟基苯甲醛 is 1620-98-0.
What is the molecular formula of 3,5-二叔丁基-4-羟基苯甲醛?
The molecular formula of 3,5-二叔丁基-4-羟基苯甲醛 is C15H22O2.
What is the molecular weight of 3,5-二叔丁基-4-羟基苯甲醛?
The molecular weight of 3,5-二叔丁基-4-羟基苯甲醛 is 234.16 g/mol.
Where can I buy 3,5-二叔丁基-4-羟基苯甲醛?
You can request a quote for 3,5-二叔丁基-4-羟基苯甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二叔丁基-4-羟基苯甲醛?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二叔丁基-4-羟基苯甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.