BGC > Product Search > Sodium 4-(2-(2-(2-chloro-3-(2-(3,3-dimethyl-1-(4-sulfonatobutyl)-3H-indolium-2-yl)vinyl)cyclohex-2-enylidene)ethylidene)-3,3-dimethylindolin-1-yl)butane-1-sulfonate | 115970-66-6

Molecular Formula: C38H46ClN2NaO6S2
Molecular Weight: 749.35
WGKGermany: 3
HS Code: 29339900

Molecular Formula: C38H46ClN2O6S2.Na
Molecular Weight: 749,35

Molecular Formula: C38H46ClN2O6S2.Na
Molecular Weight: 749,35

Molecular Formula: C38H46ClN2O6S2.Na
Molecular Weight: 749,35

Molecular Formula: C38H46ClN2O6S2.Na
Molecular Weight: 749,35

Description :
IR-783 is a cyanine dye used for labeling glycoprotein activity in tumors.

• Molecular Weight :749.35
• Melting Point :209-212°C
• Purity :≥95%

Molecular Formula :
C38H46ClN2NaO6S2
Canonical SMILES :
CC1(C2=CC=CC=C2[N+](=C1C=CC3=C(C(=CC=C4C(C5=CC=CC=C5N4CCCCS(=O)(=O)[O-])(C)C)CCC3)Cl)CCCCS(=O)(=O)[O-])C.[Na+]
InChI :
InChI=1S/C38H47ClN2O6S2.Na/c1-37(2)30-16-5-7-18-32(30)40(24-9-11-26-48(42,43)44)34(37)22-20-28-14-13-15-29(36(28)39)21-23-35-38(3,4)31-17-6-8-19-33(31)41(35)25-10-12-27-49(45,46)47;/h5-8,16-23H,9-15,24-27H2,1-4H3,(H-,42,43,44,45,46,47);/q;+1/p-1
InChIKey :
QQIQAVJARACLHE-UHFFFAOYSA-M
Solubility :
Soluble in DMF, DMSO, Ethanol
Appearance :
Red to Dark Blue to Black Powder to Crystal
Storage : Store at -20°C
Synonyms :
3H-Indolium, 2-[2-[2-chloro-3-[2-[1,3-dihydro-3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2-ylidene]ethylidene]-1-cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-(4-sulfobutyl)-, inner salt, sodium salt (1:1); 3H-Indolium, 2-[2-[2-chloro-3-[[1,3-dihydro-3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2-ylidene]ethylidene]-1-cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-(4-sulfobutyl)-, inner salt, monosodium salt; ADS 780WS; IR 783; IR783; S 0121; S 0121 (dye); 2-[2-[2-Chloro-3-[2-[1,3-dihydro-3,3-dimethyl-1-(4-sulfobutyl)-2H-indol-2-ylidene]-ethylidene]-1-cyclohexen-1-yl]-ethenyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium hydroxide, inner salt, sodium salt

More details are to be found here

Smile code:
O=S(CCCC[N+]1=C(/C=C/C2=C(Cl)/C(CCC2)=C/C=C3N(CCCCS(=O)([O-])=O)C4=C(C=CC=C4)C3(C)C)C(C)(C)C5=C1C=CC=C5)([O-])=O.[Na+]
MDL Number:
MFCD03093208
Purity :
98%
Available in stock:
114.908 g

More details are to be found here

Smile code:
O=S(CCCC[N+]1=C(/C=C/C2=C(Cl)/C(CCC2)=C/C=C3N(CCCCS(=O)([O-])=O)C4=C(C=CC=C4)C3(C)C)C(C)(C)C5=C1C=CC=C5)([O-])=O.[Na+]
MDL Number:
MFCD03093208
Purity :
98%
Available in stock:
114.908 g

More details are to be found here

Smile code:
O=S(CCCC[N+]1=C(/C=C/C2=C(Cl)/C(CCC2)=C/C=C3N(CCCCS(=O)([O-])=O)C4=C(C=CC=C4)C3(C)C)C(C)(C)C5=C1C=CC=C5)([O-])=O.[Na+]
MDL Number:
MFCD03093208
Purity :
98%
Available in stock:
114.908 g

More details are to be found here