(2,5-Difluorophenyl)thiourea

C₇H₆F₂N₂SCAS 207981-44-0188.20 g/mol

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Properties

Molecular formula: C₇H₆F₂N₂S
Molar mass: 188.20 g/mol
Exact mass: 188.0220 Da
logP: 1.62Crippen estimate
Polar surface area: 38.0 Å²
H-bond donors / acceptors: 2 / 1
Rotatable bonds: 1

Identifiers

CAS number

207981-44-0

SMILES

C1=CC(=C(C=C1F)NC(=S)N)F

InChIKey

JBWSNSWRTOFDBM-UHFFFAOYSA-N

InChI

InChI=1S/C7H6F2N2S/c8-4-1-2-5(9)6(3-4)11-7(10)12/h1-3H,(H3,10,11,12)

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

Names and synonyms

1 names

2,5-Difluorophenylthiourea

Work with (2,5-Difluorophenyl)thiourea

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

2,5-Difluorophenylhydrazine monohydrochloride175135-73-650 % similar Imidodicarbonimidic diamide, N-(2,5-difluorophenyl)-, hydrochloride (1:1)66088-53-750 % similar 1,2,4-Trifluorobenzene367-23-741 % similar 2,5-Difluoroaniline367-30-640 % similar 1-(2,4-Difluorophenyl)biguanide hydrochloride66088-52-638 % similar 2,5-Difluorobenzonitrile64248-64-237 % similar 2,5-Difluorobenzenemethanamine85118-06-537 % similar 2,5-Difluorophenol2713-31-736 % similar

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

Same formula

N-(2,4-Difluorophenyl)thiourea175277-76-6

Elsewhere

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