Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)
TL;DR: Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) (CAS 67584-64-9) is a chemical compound with molecular formula C15H25NO4 and molecular weight 283.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butylbenzoic acid;2-(2-hydroxyethylamino)ethanol
Also Known As: Diethanolamine, p-tert-butylbenzoate salt, p-tert-Butylbenzoic acid, diethanolamine salt, p-t-Butylbenzoic acid, diethanolamine salt, 4-tert-butylbenzoic acid- 2,2'-iminodiethanol(1:1), Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis[ethanol] (1:1)
| Molecular Formula | C15H25NO4 |
|---|---|
| Molecular Weight | 283.18 g/mol |
| LogP | 1.24 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.17834 |
| Heavy Atoms | 20 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 67584-64-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)O.C(CO)NCCO |
| InChIKey | BSDFUUPCYXVBBN-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) (CAS 67584-64-9), with molecular formula C15H25NO4 and molecular weight 283.18 g/mol. IUPAC: 4-tert-butylbenzoic acid;2-(2-hydroxyethylamino)ethanol.
Chemical Property Profile of Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)
Property Insights of Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)
The XLogP value of 1.24 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1). The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1). Following Lipinski's Rule of Five, Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) has 4 hydrogen bond donor(s) and 5 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 Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)?
The CAS number of Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) is 67584-64-9.
What is the molecular formula of Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)?
The molecular formula of Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) is C15H25NO4.
What is the molecular weight of Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)?
The molecular weight of Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) is 283.18 g/mol.
Where can I buy Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)?
You can request a quote for Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-(1,1-dimethylethyl)-, compd. with 2,2'-iminobis(ethanol) (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.