2-[8-[8-(Diaminomethylideneamino)octylamino]octyl]guanidine;4-dodecylbenzenesulfonic acid

Base Information

• Chemical Name: 2-[8-[8-(Diaminomethylideneamino)octylamino]octyl]guanidine;4-dodecylbenzenesulfonic acid
• CAS No.: 169202-06-6
• Molecular Formula: C72H131N7O9S3
• Molecular Weight: 1335.04704
• European Community (EC) Number: 694-684-3
• Mol file: 169202-06-6.mol

Synonyms:169202-06-6;Iminoctadine Albesilate;Iminoctadine trialbesilate;2-[8-[8-(diaminomethylideneamino)octylamino]octyl]guanidine;4-dodecylbenzenesulfonic acid;RSMZOWHDSMOOTO-UHFFFAOYSA-N;Benzenesulfonic acid, dodecyl-, compd. with N,N'''-(iminodi-8,1-octanediyl)bis[guanidine] (3:1);Guanidine, N,N'''-(iminodi-8,1-octanediyl)bis-, tris(dodecylbenzenesulfonate) (9CI);Bellkute;DF 250;DF 250 (fungicide);Iminoctadine tris(albesilate)

Chemical Property of 2-[8-[8-(Diaminomethylideneamino)octylamino]octyl]guanidine;4-dodecylbenzenesulfonic acid

Chemical Property:

• Melting Point: approximate 94℃
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 54
• Exact Mass: 1333.91704230
• Heavy Atom Count: 91
• Complexity: 653

Purity/Quality:

98%Min ^*data from raw suppliers

IMINOCTADINE ALBESILATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T+,N
• Hazard Codes: T+,N
• Statements: 20/21-26-41-50/53
• Safety Statements: 26-28-36/37/39-45-60-61

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C(CCCCN=C(N)N)CCCNCCCCCCCCN=C(N)N