1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate
TL;DR: 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate (CAS 42137-32-6) is a chemical compound with molecular formula C15H20N2O4 and molecular weight 292.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E)-7-ethoxy-7-oxo-6-(phenylhydrazinylidene)heptanoic acid
Also Known As: EINECS 255-676-1, 1-ethylhydrogen2- heptane-1,7-dioate, 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate, 2-phenylhydrazono-heptanedioic acid-1-ethyl ester, 2-(Phenyl-hydrazono)-heptanedioic acid 1-ethyl ester
| Molecular Formula | C15H20N2O4 |
|---|---|
| Molecular Weight | 292.14 g/mol |
| LogP | 2.6626 |
| Topological Polar Surface Area | 87.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 292.1423 |
| Heavy Atoms | 21 |
| Complexity | 485.7068 |
Chemical Identifiers
| CAS Number | 42137-32-6 |
|---|---|
| SMILES | CCOC(=O)/C(=N/NC1=CC=CC=C1)/CCCCC(=O)O |
Product Overview
1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate (CAS 42137-32-6), with molecular formula C15H20N2O4 and molecular weight 292.14 g/mol. IUPAC: (6E)-7-ethoxy-7-oxo-6-(phenylhydrazinylidene)heptanoic acid.
Chemical Property Profile of 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate
Property Insights of 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate
The XLogP value of 2.6626 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate. The TPSA of 87.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate. Following Lipinski's Rule of Five, 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate 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 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate?
The CAS number of 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate is 42137-32-6.
What is the molecular formula of 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate?
The molecular formula of 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate is C15H20N2O4.
What is the molecular weight of 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate?
The molecular weight of 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate is 292.14 g/mol.
Where can I buy 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate?
You can request a quote for 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl hydrogen 2-(phenylhydrazono)heptane-1,7-dioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.