NIR-667 N-succinimidyl ester

Base Information

• Chemical Name: NIR-667 N-succinimidyl ester
• CAS No.: 158358-57-7
• Molecular Formula: C30H35ClN4O5
• Molecular Weight: 567.08
• European Community (EC) Number: 633-893-6
• Mol file: 158358-57-7.mol

Synonyms:NIR-667 N-succinimidyl ester;151134-79-1;NIR-1;158358-57-7;[9-cyano-6-(diethylamino)xanthen-3-ylidene]-[6-(2,5-dioxopyrrolidin-1-yl)oxy-6-oxohexyl]-ethylazanium;chloride;1-Hexanaminium,N-[9-cyano-6-(diethylamino)-3H-xanthen-3-ylidene]-6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-N-ethyl-6-oxo-, chloride;AKOS015909982;FT-0741091;J-009492;Xanthylium,9-cyano-3-(diethylamino)-6-[[6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]ethylamino]-,chloride(1:1)

Chemical Property of NIR-667 N-succinimidyl ester

Chemical Property:

• PSA: 106.86000
• LogP: 1.15708
• Storage Temp.: −20°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 12
• Exact Mass: 566.2295979
• Heavy Atom Count: 40
• Complexity: 1140

Purity/Quality:

97% ^*data from raw suppliers

9-Cyano-N,N,N′-triethylpyronine-N′-caproic acid N-hydroxysuccinimide ester chloride ≥85% (HPLC) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

Useful:

• Canonical SMILES: CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CCCCCC(=O)ON4C(=O)CCC4=O)C=C3O2)C#N.[Cl-]