5-Carboxyfluorescein N-succinimidyl ester

C₂₅H₁₅NO₉CAS 92557-80-7473.39 g/mol

Open in Covalent MOL file

Amide Ester Ether Lactam Lactone Phenol

Properties

Molecular formula: C₂₅H₁₅NO₉
Molar mass: 473.39 g/mol
Exact mass: 473.0747 Da
logP: 2.89Crippen estimate
Polar surface area: 139.7 Å²
H-bond donors / acceptors: 2 / 9
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

92557-80-7

SMILES

C1CC(=O)N(C1=O)OC(=O)C2=CC3=C(C=C2)C4(C5=C(C=C(C=C5)O)OC6=C4C=CC(=C6)O)OC3=O

InChIKey

GECIDMICWWDIBO-UHFFFAOYSA-N

InChI

InChI=1S/C25H15NO9/c27-13-2-5-17-19(10-13)33-20-11-14(28)3-6-18(20)25(17)16-4-1-12(9-15(16)24(32)34-25)23(31)35-26-21(29)7-8-22(26)30/h1-6,9-11,27-28H,7-8H2

Weigh it out

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Work with 5-Carboxyfluorescein N-succinimidyl ester

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-FAM76823-03-567 % similar 3',6'-Dihydroxy-3-oxospiro(isobenzofuran-1(3H),9'-(9H)xanthene)-ar-carboxylic acid72088-94-963 % similar Fluorescein2321-07-560 % similar 5-Aminofluorescein3326-34-960 % similar 6-Carboxyfluorescein3301-79-958 % similar 6-Amino-3′,6′-dihydroxyspiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3-one51649-83-354 % similar Fluorescein 5-isothiocyanate3326-32-754 % similar Fluorescein 6-isothiocyanate18861-78-449 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Carboxyfluorescein succinimidyl ester92557-81-8

Elsewhere

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