RefChem:345916
TL;DR: RefChem:345916 (CAS 35689-12-4) is a chemical compound with molecular formula C15H16ClNO5 and molecular weight 325.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(furo[2,3-g][1,4]benzodioxine-7-carbonyloxy)ethyl-dimethylazanium chloride
Also Known As: Furo(2,3-g)-1,4-benzodioxin-7-carboxylic acid, dimethylaminoethyl ester, hydrochloride, 2-(Furo[2,3-g][1,4]benzodioxine-7-carbonyloxy)ethyl-dimethylazaniumchloride, 2-(furo[2,3-g][1,4]benzodioxine-7-carbonyloxy)ethyl-dimethylazanium chloride, FURO(2,3-g)-1,4-BENZODIOXIN-7-CARBOXYLIC ACID, DIMETHYLAMINOETHYL ESTER, HYDROCH, RefChem:345916
| Molecular Formula | C15H16ClNO5 |
|---|---|
| Molecular Weight | 325.07 g/mol |
| LogP | -2.02 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.0717 |
| Heavy Atoms | 22 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 35689-12-4 |
|---|---|
| SMILES | C[NH+](C)CCOC(=O)C1=CC2=CC3=C(C=C2O1)OC=CO3.[Cl-] |
| InChIKey | LEFJGHRHFHYQHY-UHFFFAOYSA-N |
Product Overview
RefChem:345916 (CAS 35689-12-4), with molecular formula C15H16ClNO5 and molecular weight 325.07 g/mol. IUPAC: 2-(furo[2,3-g][1,4]benzodioxine-7-carbonyloxy)ethyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:345916
Property Insights of RefChem:345916
The XLogP value of -2.02 indicates that RefChem:345916 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:345916. Following Lipinski's Rule of Five, RefChem:345916 has 1 hydrogen bond donor(s) and 6 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 RefChem:345916?
The CAS number of RefChem:345916 is 35689-12-4.
What is the molecular formula of RefChem:345916?
The molecular formula of RefChem:345916 is C15H16ClNO5.
What is the molecular weight of RefChem:345916?
The molecular weight of RefChem:345916 is 325.07 g/mol.
Where can I buy RefChem:345916?
You can request a quote for RefChem:345916 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:345916?
Yes, KEHONG BIO provides custom synthesis services for RefChem:345916 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.