4,4'-(1,4-Butanediyldiimino)bisbutanal
TL;DR: 4,4'-(1,4-Butanediyldiimino)bisbutanal (CAS 22868-59-3) is a chemical compound with molecular formula C12H24N2O2 and molecular weight 228.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-oxobutylamino)butylamino]butanal
Also Known As: POX 3, 4,4'-(1,4-Butanediyldiimino)bisbutanal, 4,4'-(butane-1,4-diyldiimino)dibutanal, Butanal, 4,4'-(1,4-butanediyldiimino)bis-, 4-[4-(4-oxobutylamino)butylamino]butanal
| Molecular Formula | C12H24N2O2 |
|---|---|
| Molecular Weight | 228.18 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 228.18378 |
| Heavy Atoms | 16 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 22868-59-3 |
|---|---|
| SMILES | C(CCNCCCC=O)CNCCCC=O |
| InChIKey | TURWXBQPPKQQIC-UHFFFAOYSA-N |
Product Overview
4,4'-(1,4-Butanediyldiimino)bisbutanal (CAS 22868-59-3), with molecular formula C12H24N2O2 and molecular weight 228.18 g/mol. IUPAC: 4-[4-(4-oxobutylamino)butylamino]butanal.
Chemical Property Profile of 4,4'-(1,4-Butanediyldiimino)bisbutanal
Property Insights of 4,4'-(1,4-Butanediyldiimino)bisbutanal
The XLogP value of -0.3 indicates that 4,4'-(1,4-Butanediyldiimino)bisbutanal is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.2 Ų, 4,4'-(1,4-Butanediyldiimino)bisbutanal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-(1,4-Butanediyldiimino)bisbutanal has 2 hydrogen bond donor(s) and 4 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 4,4'-(1,4-Butanediyldiimino)bisbutanal?
The CAS number of 4,4'-(1,4-Butanediyldiimino)bisbutanal is 22868-59-3.
What is the molecular formula of 4,4'-(1,4-Butanediyldiimino)bisbutanal?
The molecular formula of 4,4'-(1,4-Butanediyldiimino)bisbutanal is C12H24N2O2.
What is the molecular weight of 4,4'-(1,4-Butanediyldiimino)bisbutanal?
The molecular weight of 4,4'-(1,4-Butanediyldiimino)bisbutanal is 228.18 g/mol.
Where can I buy 4,4'-(1,4-Butanediyldiimino)bisbutanal?
You can request a quote for 4,4'-(1,4-Butanediyldiimino)bisbutanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-(1,4-Butanediyldiimino)bisbutanal?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-(1,4-Butanediyldiimino)bisbutanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.