5-(3-Fluorophenyl)-2H-1,2,3,4-tetrazole

C₇H₅FN₄CAS 50907-20-5164.14 g/mol

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Properties

Molecular formula: C₇H₅FN₄
Molar mass: 164.14 g/mol
Exact mass: 164.0498 Da
logP: 1.01Crippen estimate
Polar surface area: 54.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

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

50907-20-5

SMILES

C1=CC(=CC(=C1)F)C2=NNN=N2

InChIKey

SEYSTLGMSOLFBD-UHFFFAOYSA-N

InChI

InChI=1S/C7H5FN4/c8-6-3-1-2-5(4-6)7-9-11-12-10-7/h1-4H,(H,9,10,11,12)

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Names and synonyms

1 names

5-(3-Fluorophenyl)-1H-tetrazole

Work with 5-(3-Fluorophenyl)-2H-1,2,3,4-tetrazole

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-(3-Bromophenyl)-2H-tetrazole3440-99-162 % similar 5-(3-Aminophenyl)tetrazole73732-51-162 % similar 5-Phenyltetrazole18039-42-460 % similar 5-[4-(2H-Tetrazol-5-yl)phenyl]-2H-tetrazole6926-49-455 % similar 3-(2H-Tetrazol-5-yl)pyridine3250-74-651 % similar 3,3′-Difluoro-1,1′-biphenyl396-64-550 % similar 5-(2,6-Dichlorophenyl)-1H-tetrazole50907-31-850 % similar 5-(4-Pyridyl)-1H-tetrazole14389-12-948 % similar

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

Same formula

5-(4-Fluorophenyl)-1H-tetrazole50907-21-6

Elsewhere

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