对叔丁基苯甲酰胺
TL;DR: 对叔丁基苯甲酰胺 (CAS 56108-12-4) is a chemical compound with molecular formula C11H15NO and molecular weight 177.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对叔丁基苯甲酰胺
4-tert-butylbenzamide
Also Known As: 4-tert-butylbenzamide, 4-(tert-Butyl)benzamide, p-(tert-butyl)benzamide, 4-t-butylbenzamide, p-t-butylbenzamide
| Molecular Formula | C11H15NO |
|---|---|
| Molecular Weight | 177.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.11537 |
| Heavy Atoms | 13 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 56108-12-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)N |
| InChIKey | VIPMBJSGYWWHAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对叔丁基苯甲酰胺 (CAS 56108-12-4), with molecular formula C11H15NO and molecular weight 177.12 g/mol. IUPAC: 4-tert-butylbenzamide.
Chemical Property Profile of 对叔丁基苯甲酰胺
Property Insights of 对叔丁基苯甲酰胺
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 对叔丁基苯甲酰胺. With a topological polar surface area (TPSA) of 43.1 Ų, 对叔丁基苯甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对叔丁基苯甲酰胺 has 1 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 对叔丁基苯甲酰胺?
The CAS number of 对叔丁基苯甲酰胺 is 56108-12-4.
What is the molecular formula of 对叔丁基苯甲酰胺?
The molecular formula of 对叔丁基苯甲酰胺 is C11H15NO.
What is the molecular weight of 对叔丁基苯甲酰胺?
The molecular weight of 对叔丁基苯甲酰胺 is 177.12 g/mol.
Where can I buy 对叔丁基苯甲酰胺?
You can request a quote for 对叔丁基苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对叔丁基苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 对叔丁基苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.