4-Ethyl-5-fluoropyrimidine

C₆H₇FN₂CAS 137234-88-9126.13 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₇FN₂
Molar mass: 126.13 g/mol
Exact mass: 126.0593 Da
logP: 1.18Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowed100% of notifiers
H351 Suspected of causing cancer100% of notifiers
H360 May damage fertility or the unborn child100% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure100% of notifiers
H412 Harmful to aquatic life with long lasting effects100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P264, P270, P273, P280, P301+P316, P318, P319, P321, P330, P405, P501

Identifiers

CAS number

137234-88-9

SMILES

CCc1ncncc1F

InChIKey

AYZDRTRWCASUFO-UHFFFAOYSA-N

InChI

InChI=1S/C6H7FN2/c1-2-6-5(7)3-8-4-9-6/h3-4H,2H2,1H3

Weigh it out

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

Names and synonyms

1 names

Pyrimidine, 4-ethyl-5-fluoro-

Work with 4-Ethyl-5-fluoropyrimidine

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-Fluoro-4(3H)-pyrimidinone671-35-245 % similar 4-Chloro-6-ethyl-5-fluoropyrimidine137234-74-343 % similar 6-Ethyl-5-fluoro-4(3H)-pyrimidinone137234-87-843 % similar 2,5-Diethylpyrazine13238-84-139 % similar 2,3-Diethylpyrazine15707-24-139 % similar 4,5-Dichloro-6-ethylpyrimidine115617-41-937 % similar 2,3-Diethyl-5-methylpyrazine18138-04-035 % similar 3,4,5-Trifluoropyridine67815-54-734 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Pyridinamine,5-fluoro-6-methyl-(9ci)110919-71-6 2-Fluoro-4-methylpyridin-3-amine173435-32-0 2-Fluoro-3-methyl-5-aminopyridine186593-48-6 (5-Fluoropyridin-3-yl)methanamine23586-96-1 (2-Fluorophenyl)hydrazine2368-80-1 3-Amino-6-fluoro-2-methylpyridine28489-47-6 2-Amino-5-fluoro-4-methylpyridine301222-66-2 4-Fluoro-1,2-phenylenediamine367-31-7

Elsewhere

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