Glucosyl fluoride

C₆H₁₁FO₅CAS 2106-10-7182.15 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide Ether

Properties

Molecular formula: C₆H₁₁FO₅
Molar mass: 182.15 g/mol
Exact mass: 182.0591 Da
logP: -2.24Crippen estimate
Polar surface area: 90.2 Å²
H-bond donors / acceptors: 4 / 5
Rotatable bonds: 1
Stereocentres: R, S, S, Rin SMILES atom order

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

2106-10-7

SMILES

C([C@@H]1[C@H]([C@@H]([C@H](C(O1)F)O)O)O)O

InChIKey

ATMYEINZLWEOQU-GASJEMHNSA-N

InChI

InChI=1S/C6H11FO5/c7-6-5(11)4(10)3(9)2(1-8)12-6/h2-6,8-11H,1H2/t2-,3-,4+,5-,6?/m1/s1

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Work with Glucosyl fluoride

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

D-Galactopyranose10257-28-057 % similar β-D-Glucose492-61-557 % similar α-D-Glucose492-62-657 % similar β-D-Allopyranose7283-09-257 % similar Beta-D-glucose9001-37-057 % similar β-Galactosidase9031-11-257 % similar Trehalose99-20-757 % similar α-D-Glucose monohydrate14431-43-752 % similar

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

Same formula

2-Fluoro-2-deoxy-D-glucose29702-43-0 6-Fluoro-6-deoxy-D-glucopyranose34168-77-9

Elsewhere

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