chempirical

2-Fluorothiobenzamide

C7H6FNSCAS 75907-82-3155.19 g/mol

Open in Covalent MOL file
SNH2F
Aryl halide

Properties

Molecular formula
C7H6FNS
Molar mass
155.19 g/mol
Exact mass
155.0205 Da
logP
1.46Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
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
75907-82-3
SMILES
C1=CC=C(C(=C1)C(=S)N)F
InChIKey
IEMYDFIJEIAQCO-UHFFFAOYSA-N
InChI
InChI=1S/C7H6FNS/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H2,9,10)

Weigh it out

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

Work with 2-Fluorothiobenzamide

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

2,4-Difluorobenzene-1-carbothioamide175276-92-360 % similar 2-Chlorothiobenzamide15717-17-655 % similar 2-Fluorobenzhydrazide446-24-247 % similar 2,3-Dichloro-thiobenzamide84863-83-247 % similar 2-Fluorobenzoyl chloride393-52-245 % similar 2′-Fluoroacetophenone445-27-245 % similar 2-Fluorobenzamide445-28-345 % similar 2-Fluorobenzoic acid445-29-445 % similar

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

Same formula

4-Fluorothiobenzamide22179-72-2

Elsewhere

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