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Sulforhodamine G

CAT: 1489-S6800Size: 1 gDry Ice: NoHazardous: No
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CAS Number
5873-16-5

Chemical Information

Sulforhodamine G

Sulforhodamine G is a xanthene dye and an organic sodium salt. It has a role as a fluorochrome. It contains a sulforhodamine G anion.

CAS Number5873-16-5
PubChem CID65196
IUPAC Namesodium 4-[3-(ethylamino)-6-ethylazaniumylidene-2,7-dimethylxanthen-9-yl]benzene-1,3-disulfonate
Molecular FormulaC25H25N2NaO7S2
Molecular Weight552.6
Topological Polar Surface Area166
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count37
Formal Charge0
Complexity1130
SMILES
CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=C(C=C(C=C4)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C25H26N2O7S2.Na/c1-5-26-20-12-22-18(9-14(20)3)25(19-10-15(4)21(27-6-2)13-23(19)34-22)17-8-7-16(35(28,29)30)11-24(17)36(31,32)33;/h7-13,26H,5-6H2,1-4H3,(H,28,29,30)(H,31,32,33);/q;+1/p-1
InChIKey
NWWFZBYHUXCUDI-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sulforhodamine G
CAS: 5873-16-5
CID: 65196
Formula: C25H25N2NaO7S2
MW: 552.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight552.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass552.10008777
Monoisotopic Mass552.10008777
Topological Polar Surface Area166 Ų
Heavy Atom Count37
Formal Charge0
Complexity1130
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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