EINECS 300-369-0
TL;DR: EINECS 300-369-0 (CAS 93939-79-8) is a chemical compound with molecular formula C13H16NNaO4 and molecular weight 273.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 2-cyclohexa-1,4-dien-1-yl-2-[(4-methoxy-4-oxobut-2-en-2-yl)amino]acetate
Also Known As: EINECS 300-369-0, Sodium (R,E)-2-(cyclohexa-1,4-dien-1-yl)-2-((4-methoxy-4-oxobut-2-en-2-yl)amino)acetate, Sodium (Z)-alpha-((3-methoxy-1-methyl-3-oxo-1-propenyl)amino)cyclohexa-1,4-diene-1-acetate, sodium 2-cyclohexa-1,4-dien-1-yl-2-[(4-methoxy-4-oxobut-2-en-2-yl)amino]acetate, Sodium alpha-((3-methoxy-1-methyl-3-oxo-1-propenyl)amino)cyclohexa-1,4-diene-1-acetate
| Molecular Formula | C13H16NNaO4 |
|---|---|
| Molecular Weight | 273.10 g/mol |
| LogP | -2.9483 |
| Topological Polar Surface Area | 78.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.09772 |
| Heavy Atoms | 19 |
| Complexity | 426.35916 |
Chemical Identifiers
| CAS Number | 93939-79-8 |
|---|---|
| SMILES | CC(=CC(=O)OC)NC(C1=CCC=CC1)C(=O)[O-].[Na+] |
Product Overview
EINECS 300-369-0 (CAS 93939-79-8), with molecular formula C13H16NNaO4 and molecular weight 273.10 g/mol. IUPAC: sodium 2-cyclohexa-1,4-dien-1-yl-2-[(4-methoxy-4-oxobut-2-en-2-yl)amino]acetate.
Chemical Property Profile of EINECS 300-369-0
Property Insights of EINECS 300-369-0
The XLogP value of -2.9483 indicates that EINECS 300-369-0 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.46 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 300-369-0. Following Lipinski's Rule of Five, EINECS 300-369-0 has 1 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 300-369-0?
The CAS number of EINECS 300-369-0 is 93939-79-8.
What is the molecular formula of EINECS 300-369-0?
The molecular formula of EINECS 300-369-0 is C13H16NNaO4.
What is the molecular weight of EINECS 300-369-0?
The molecular weight of EINECS 300-369-0 is 273.10 g/mol.
Where can I buy EINECS 300-369-0?
You can request a quote for EINECS 300-369-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 300-369-0?
Yes, KEHONG BIO provides custom synthesis services for EINECS 300-369-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.