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5 (6) -FITC DA

CAT: 0862-GW3793-100mgSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0862-GW3793-100mgSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
871487-69-3
Storage Conditions
-20°C
Hazardous Class
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Chemical Information

5(6)-Fitc DA
CAS Number871487-69-3
PubChem CID122174026
IUPAC Name(6'-acetyloxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) acetate;methylimino(sulfanylidene)methane
Molecular FormulaC26H19NO7S
Molecular Weight489.5
Topological Polar Surface Area133
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Heavy Atom Count35
Formal Charge0
Complexity752
SMILES
CC(=O)OC1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)OC(=O)C)C5=CC=CC=C5C(=O)O3.CN=C=S
InChI
InChI=1S/C24H16O7.C2H3NS/c1-13(25)28-15-7-9-19-21(11-15)30-22-12-16(29-14(2)26)8-10-20(22)24(19)18-6-4-3-5-17(18)23(27)31-24;1-3-2-4/h3-12H,1-2H3;1H3
InChIKey
OBUOZVWPVUSTNG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5(6)-Fitc DA
CAS: 871487-69-3
CID: 122174026
Formula: C26H19NO7S
MW: 489.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight489.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count4
Exact Mass489.08822312
Monoisotopic Mass489.08822312
Topological Polar Surface Area133 Ų
Heavy Atom Count35
Formal Charge0
Complexity752
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