Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)
TL;DR: Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) (CAS 63428-89-7) is a chemical compound with molecular formula C12H29N3O2 and molecular weight 247.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-aminoethyl)ethane-1,2-diamine;2-ethylhexanoic acid
Also Known As: Hexanoic acid, 2-ethyl-, compd. with N-(2-aminoethyl)-1,2-ethanediamine, 2-Ethylhexanoic acid, compound with N-(2-aminoethyl)ethane-1,2-diamine, Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?), N'-(2-aminoethyl)ethane-1,2-diamine,2-ethylhexanoic acid, N'-(2-aminoethyl)ethane-1,2-diamine; 2-ethylhexanoic acid
| Molecular Formula | C12H29N3O2 |
|---|---|
| Molecular Weight | 247.23 g/mol |
| LogP | 0.7808 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 247.22598 |
| Heavy Atoms | 17 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 63428-89-7 |
|---|---|
| SMILES | CCCCC(CC)C(=O)O.C(CNCCN)N |
| InChIKey | URCVXXHEMYPEDC-UHFFFAOYSA-N |
Product Overview
Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) (CAS 63428-89-7), with molecular formula C12H29N3O2 and molecular weight 247.23 g/mol. IUPAC: N'-(2-aminoethyl)ethane-1,2-diamine;2-ethylhexanoic acid.
Chemical Property Profile of Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)
Property Insights of Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)
The XLogP value of 0.7808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?). The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?). Following Lipinski's Rule of Five, Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) has 4 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 Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)?
The CAS number of Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) is 63428-89-7.
What is the molecular formula of Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)?
The molecular formula of Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) is C12H29N3O2.
What is the molecular weight of Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)?
The molecular weight of Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) is 247.23 g/mol.
Where can I buy Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)?
You can request a quote for Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?)?
Yes, KEHONG BIO provides custom synthesis services for Hexanoic acid, 2-ethyl-, compd. with N1-(2-aminoethyl)-1,2-ethanediamine (1:?) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.