5-Chlorouridine

C9H11ClN2O6CAS 2880-89-9278.64 g/mol

Open in Covalent MOL file
ONHONOOHHOOHCl
AlcoholAryl halideEther

Properties

Molecular formula
C9H11ClN2O6
Molar mass
278.64 g/mol
Exact mass
278.0306 Da
logP
-2.20Crippen estimate
Polar surface area
124.8 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
2
Stereocentres
R, R, S, Rin SMILES atom order

Hazards

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

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Identifiers

CAS number
2880-89-9
SMILES
C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)Cl
InChIKey
LDCUBKKZHSYQTJ-UAKXSSHOSA-N
InChI
InChI=1S/C9H11ClN2O6/c10-3-1-12(9(17)11-7(3)16)8-6(15)5(14)4(2-13)18-8/h1,4-6,8,13-15H,2H2,(H,11,16,17)/t4-,5-,6-,8-/m1/s1

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Type any one amount. The others follow from the molar mass.

Work with 5-Chlorouridine

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-Ethynyl uridine69075-42-967 % similar L-Uridine26287-69-459 % similar 2'-Fluorothymidine122799-38-657 % similar 2'-O-(2-Methoxyethyl)-5-methyl-uridine163759-49-752 % similar 2'-Chloro-2'-deoxyuridine4753-04-249 % similar N1-Ethylpseudouridine1613529-72-848 % similar 2-Thiouridine20235-78-348 % similar N1-Benzyl pseudouridine1613530-22-547 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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