6-Chloro-5-fluoropyrimidin-4-amine

C4H3ClFN3CAS 851984-15-1147.54 g/mol

Open in Covalent MOL file
NNClFNH2
Aryl halidePrimary amine

Properties

Molecular formula
C4H3ClFN3
Molar mass
147.54 g/mol
Exact mass
147.0000 Da
logP
0.85Crippen estimate
Polar surface area
51.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
851984-15-1
SMILES
C1=NC(=C(C(=N1)Cl)F)N
InChIKey
FEIFDRDCVMVUJA-UHFFFAOYSA-N
InChI
InChI=1S/C4H3ClFN3/c5-3-2(6)4(7)9-1-8-3/h1H,(H2,7,8,9)

Weigh it out

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Names and synonyms

1 names
  • 4-Amino-6-chloro-5-fluoropyrimidine

Work with 6-Chloro-5-fluoropyrimidin-4-amine

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

4,6-Dichloro-5-fluoropyrimidine213265-83-967 % similar 5,6-Dichloropyrimidin-4-amine310400-38-557 % similar 6-Chloro-5-methylpyrimidin-4-amine14394-56-053 % similar 4-Amino-6-chloropyrimidin-5-ol38953-42-353 % similar 4-Chloro-6-ethyl-5-fluoropyrimidine137234-74-348 % similar 4-Amino-6-chloropyrimidine-5-carbonitrile60025-09-448 % similar 5-Amino-4,6-dichloropyrimidine5413-85-448 % similar 4-(1-Bromoethyl)-6-chloro-5-fluoropyrimidine188416-28-644 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Chloro-5-fluoro-4-pyrimidinamine155-10-2 2-Amino-4-chloro-5-fluoropyrimidine1683-75-6

Elsewhere

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