4,8,12,17,21,25-Hexaazaoctacosane-1,28-diamine, 4,25-bis(3-aminopropyl)-12,17-(3-(bis(3-(bis(3-aminopropyl)amino)propyl)amino)propyl)-8,21-bis(3-(bis(3-aminopropyl)amino)propyl)-

Base Information

• Chemical Name: 4,8,12,17,21,25-Hexaazaoctacosane-1,28-diamine, 4,25-bis(3-aminopropyl)-12,17-(3-(bis(3-(bis(3-aminopropyl)amino)propyl)amino)propyl)-8,21-bis(3-(bis(3-aminopropyl)amino)propyl)-
• CAS No.: 154487-85-1
• Molecular Formula: C88H208 N30
• Molecular Weight: 1686.82
• European Community (EC) Number: 620-781-7
• DSSTox Substance ID: DTXSID601098939
• Nikkaji Number: J1.311.433A
• Mol file: 154487-85-1.mol

Synonyms:154487-85-1;N,N,N',N'-tetrakis[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]butane-1,4-diamine;4,8,12,17,21,25-Hexaazaoctacosane-1,28-diamine, 4,25-bis(3-aminopropyl)-12,17-(3-(bis(3-(bis(3-aminopropyl)amino)propyl)amino)propyl)-8,21-bis(3-(bis(3-aminopropyl)amino)propyl)-;4,8,12,17,21,25-Hexaazaoctacosane-1,28-diamine, 4,25-bis(3-aminopropyl)-12,17-[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]-8,21-bis[3-[bis(3-aminopropyl)amino]propyl]-;SCHEMBL2609752;MVMZFIQOIDKSFP-UHFFFAOYSA-N;DTXSID601098939;AKOS015915958;C88H208N30;C88-H208-N30;1,4-bis[bis[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]amino]butane;4,25-Bis(3-aminopropyl)-12,17-[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]-8,21-bis[3-[bis(3-aminopropyl)amino]propyl]-4,8,12,17,21,25-hexaazaoctacosane-1,28-diamine

Chemical Property of 4,8,12,17,21,25-Hexaazaoctacosane-1,28-diamine, 4,25-bis(3-aminopropyl)-12,17-(3-(bis(3-(bis(3-aminopropyl)amino)propyl)amino)propyl)-8,21-bis(3-(bis(3-aminopropyl)amino)propyl)-

Chemical Property:

• Refractive Index: n20/D 1.515(lit.)
• Flash Point: 113 °C
• PSA: 461.68000
• Density: 1.01 g/mL at 25 °C(lit.)
• LogP: 11.46140
• XLogP3: -3.6
• Hydrogen Bond Donor Count: 16
• Hydrogen Bond Acceptor Count: 30
• Rotatable Bond Count: 101
• Exact Mass: 1685.71982676
• Heavy Atom Count: 118
• Complexity: 1500

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-37/38-41
• Safety Statements: 26-27-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CN(CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN)CCCN(CCCN(CCCN)CCCN)CCCN(CCCN)CCCN

Technology Process of 4,8,12,17,21,25-Hexaazaoctacosane-1,28-diamine, 4,25-bis(3-aminopropyl)-12,17-(3-(bis(3-(bis(3-aminopropyl)amino)propyl)amino)propyl)-8,21-bis(3-(bis(3-aminopropyl)amino)propyl)-

There total 1 articles about 4,8,12,17,21,25-Hexaazaoctacosane-1,28-diamine, 4,25-bis(3-aminopropyl)-12,17-(3-(bis(3-(bis(3-aminopropyl)amino)propyl)amino)propyl)-8,21-bis(3-(bis(3-aminopropyl)amino)propyl)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

C88H144N30 → 1,4-bis[bis[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]amino]butane (154487-85-1)

Guidance literature:

With hydrogen; cobalt; In methanol; water; at 70 ℃; for 1h; under 30400 Torr;

Reference yield:

formaldehyd (50-00-0,30525-89-4,61233-19-0) + methyl phosphite (96-36-6,868-85-9) + 1,4-bis[bis[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]amino]butane (154487-85-1) → C184H432N30O96P32

Guidance literature:

In water; at 0 - 80 ℃;

Reference yield:

p-OH-C6H4C[(CH2)3SiMe2CH2NHCO-ferrocenyl]3 + 1,4-bis[bis[3-[bis[3-[bis(3-aminopropyl)amino]propyl]amino]propyl]amino]butane (154487-85-1) → 16((C5H5FeC5H4CONHCH2Si(CH3)2C3H6)3CC6H4OH)*(NH2C3H6)16(NC3H6)8(C3H6N)4N2C4H8

Guidance literature:

In chloroform-d1; a soln. of dendron in CDCl3 was added to a soln. of amine in CDCl3 in NMR tube; not sepd., detected by NMR spectra;

DOI:10.1021/ic0493999

Refernces