N,N-Diethylmaleamic acid
TL;DR: N,N-Diethylmaleamic acid (CAS 765230-15-7) is a chemical compound with molecular formula C8H13NO3 and molecular weight 171.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-(diethylamino)-4-oxobut-2-enoic acid
Also Known As: N,N-Diethylmaleamic acid, N,N-Diethylmaleamidic acid, BB 0218387, (Z)-4-(diethylamino)-4-oxobut-2-enoic acid, (2Z)-3-(DIETHYLCARBAMOYL)PROP-2-ENOIC ACID
| Molecular Formula | C8H13NO3 |
|---|---|
| Molecular Weight | 171.09 g/mol |
| LogP | 0.4956 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 171.08954 |
| Heavy Atoms | 12 |
| Complexity | 194.47966 |
Chemical Identifiers
| CAS Number | 765230-15-7 |
|---|---|
| SMILES | CCN(CC)C(=O)/C=C\C(=O)O |
Product Overview
N,N-Diethylmaleamic acid (CAS 765230-15-7), with molecular formula C8H13NO3 and molecular weight 171.09 g/mol. IUPAC: (Z)-4-(diethylamino)-4-oxobut-2-enoic acid.
Chemical Property Profile of N,N-Diethylmaleamic acid
Property Insights of N,N-Diethylmaleamic acid
The XLogP value of 0.4956 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethylmaleamic acid. With a topological polar surface area (TPSA) of 57.61 Ų, N,N-Diethylmaleamic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethylmaleamic acid has 1 hydrogen bond donor(s) and 2 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 N,N-Diethylmaleamic acid?
The CAS number of N,N-Diethylmaleamic acid is 765230-15-7.
What is the molecular formula of N,N-Diethylmaleamic acid?
The molecular formula of N,N-Diethylmaleamic acid is C8H13NO3.
What is the molecular weight of N,N-Diethylmaleamic acid?
The molecular weight of N,N-Diethylmaleamic acid is 171.09 g/mol.
Where can I buy N,N-Diethylmaleamic acid?
You can request a quote for N,N-Diethylmaleamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethylmaleamic acid?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethylmaleamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.