EINECS 299-142-6
TL;DR: EINECS 299-142-6 (CAS 93857-08-0) is a chemical compound with molecular formula C14H22ClN3O5 and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]amino]-2-oxoethyl]-trimethylazanium chloride
Also Known As: EINECS 299-142-6, [2-[[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]amino]-2-oxoethyl]trimethylammonium chloride, (2-((2-Hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl)amino)-2-oxoethyl)trimethylammonium chloride, [2-[[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]amino]-2-oxoethyl]-trimethylazanium chloride
| Molecular Formula | C14H22ClN3O5 |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | -3.1845 |
| Topological Polar Surface Area | 112.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 347.1248 |
| Heavy Atoms | 23 |
| Complexity | 530.2094 |
Chemical Identifiers
| CAS Number | 93857-08-0 |
|---|---|
| SMILES | C[N+](C)(C)CC(=O)NC(CO)C(C1=CC=C(C=C1)[N+](=O)[O-])O.[Cl-] |
Product Overview
EINECS 299-142-6 (CAS 93857-08-0), with molecular formula C14H22ClN3O5 and molecular weight 347.12 g/mol. IUPAC: [2-[[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]amino]-2-oxoethyl]-trimethylazanium chloride.
Chemical Property Profile of EINECS 299-142-6
Property Insights of EINECS 299-142-6
The XLogP value of -3.1845 indicates that EINECS 299-142-6 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.7 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 299-142-6. Following Lipinski's Rule of Five, EINECS 299-142-6 has 3 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 EINECS 299-142-6?
The CAS number of EINECS 299-142-6 is 93857-08-0.
What is the molecular formula of EINECS 299-142-6?
The molecular formula of EINECS 299-142-6 is C14H22ClN3O5.
What is the molecular weight of EINECS 299-142-6?
The molecular weight of EINECS 299-142-6 is 347.12 g/mol.
Where can I buy EINECS 299-142-6?
You can request a quote for EINECS 299-142-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 299-142-6?
Yes, KEHONG BIO provides custom synthesis services for EINECS 299-142-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.