![Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride structure](/static/products/3394/33948-17-3.webp)
Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride
TL;DR: Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride (CAS 33948-17-3) is a chemical compound with molecular formula C15H24ClNO4 and molecular weight 317.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate;hydrochloride
Also Known As: methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride, Methyl 4-(3-(tert-butylamino)-2-hydroxypropoxy)benzoate hydrochloride, Methyl 4-[2-hydroxy-3-(tert-butylamino)propoxy]benzoate Hydrochloride
| Molecular Formula | C15H24ClNO4 |
|---|---|
| Molecular Weight | 317.14 g/mol |
| LogP | 2.0228 |
| Topological Polar Surface Area | 67.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.13937 |
| Heavy Atoms | 21 |
| Complexity | 428.29492 |
Chemical Identifiers
| CAS Number | 33948-17-3 |
|---|---|
| SMILES | CC(C)(C)NCC(COC1=CC=C(C=C1)C(=O)OC)O.Cl |
Product Overview
Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride (CAS 33948-17-3), with molecular formula C15H24ClNO4 and molecular weight 317.14 g/mol. IUPAC: methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate;hydrochloride.
Chemical Property Profile of Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride
Property Insights of Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride
The XLogP value of 2.0228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride. The TPSA of 67.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride. Following Lipinski's Rule of Five, Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride has 2 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 Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride?
The CAS number of Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride is 33948-17-3.
What is the molecular formula of Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride?
The molecular formula of Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride is C15H24ClNO4.
What is the molecular weight of Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride?
The molecular weight of Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride is 317.14 g/mol.
Where can I buy Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride?
You can request a quote for Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]benzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.