1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-
TL;DR: 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- (CAS 10596-53-9) is a chemical compound with molecular formula C12H26N4 and molecular weight 226.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,1-N,1-N',1-N',4-N,4-N,4-N',4-N'-octamethylbuta-1,3-diene-1,1,4,4-tetramine
Also Known As: 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-, 1,1,4,4-tetrakis(dimethylamino)butadiene, J3.654.927K, 1,1,4,4-Tetrakis-(dimethylamino)-butadien-(1,3), DIMETHYL[1,4,4-TRIS(DIMETHYLAMINO)BUTA-1,3-DIEN-1-YL]AMINE
| Molecular Formula | C12H26N4 |
|---|---|
| Molecular Weight | 226.22 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 13.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.21574 |
| Heavy Atoms | 16 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 10596-53-9 |
|---|---|
| SMILES | CN(C)C(=CC=C(N(C)C)N(C)C)N(C)C |
| InChIKey | MBOIPDASIHGIRS-UHFFFAOYSA-N |
Product Overview
1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- (CAS 10596-53-9), with molecular formula C12H26N4 and molecular weight 226.22 g/mol. IUPAC: 1-N,1-N,1-N',1-N',4-N,4-N,4-N',4-N'-octamethylbuta-1,3-diene-1,1,4,4-tetramine.
Chemical Property Profile of 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-
Property Insights of 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-. With a topological polar surface area (TPSA) of 13.0 Ų, 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- has 0 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 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-?
The CAS number of 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- is 10596-53-9.
What is the molecular formula of 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-?
The molecular formula of 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- is C12H26N4.
What is the molecular weight of 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-?
The molecular weight of 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- is 226.22 g/mol.
Where can I buy 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-?
You can request a quote for 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Butadiene, 1,1,4,4-tetrakis(N,N-dimethylamine)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.