2-Chloro-5-fluoro-4-pyrimidinamine

C₄H₃ClFN₃CAS 155-10-2147.54 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₃ClFN₃
Molar mass: 147.54 g/mol
Exact mass: 147.0000 Da
Melting point: 191–193 °C
logP: 0.68Crippen estimate
Polar surface area: 52.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Identifiers

CAS number

155-10-2

SMILES

N=c1[nH]c(Cl)ncc1F

InChIKey

SLQAJWTZUXJPNY-UHFFFAOYSA-N

InChI

InChI=1S/C4H3ClFN3/c5-4-8-1-2(6)3(7)9-4/h1H,(H2,7,8,9)

Weigh it out

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

Names and synonyms

7 names

4-Pyrimidinamine, 2-chloro-5-fluoro-
Pyrimidine, 4-amino-2-chloro-5-fluoro-
4-Amino-2-chloro-5-fluoropyrimidine
2-Chloro-5-fluoropyrimidin-4-ylamine
NSC 78716
2-Chloro-5-fluoropyrimidin-4-amine
2-Chloro-5-fluoro-4-aminopyrimidine

Work with 2-Chloro-5-fluoro-4-pyrimidinamine

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-Chloro-4,5-pyrimidinediamine14631-08-456 % similar Flucytosine2022-85-756 % similar 2-Chloro-5-methoxy-4-pyrimidinamine99979-77-851 % similar 2-Chloro-5-nitro-4-pyrimidinamine1920-66-747 % similar 2,4-Dichloro-5-fluoropyrimidine2927-71-135 % similar 5-Fluoro-4-iodo-1H-pyrrolo[2,3-B]pyridine1015610-23-734 % similar 2-Chloro-4-nitroimidazole57531-37-034 % similar 4-Amino-2-chloro-6,7-dimethoxyquinazoline23680-84-433 % similar

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

Same formula

2-Amino-4-chloro-5-fluoropyrimidine1683-75-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook