4,5-Dichloropyrimidin-2-amine

C₄H₃Cl₂N₃CAS 403854-21-7163.99 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₄H₃Cl₂N₃
Molar mass: 163.99 g/mol
Exact mass: 162.9704 Da
logP: 1.37Crippen estimate
Polar surface area: 51.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Identifiers

CAS number

403854-21-7

SMILES

C1=C(C(=NC(=N1)N)Cl)Cl

InChIKey

LCNPRNSOGSLJFZ-UHFFFAOYSA-N

InChI

InChI=1S/C4H3Cl2N3/c5-2-1-8-4(7)9-3(2)6/h1H,(H2,7,8,9)

Weigh it out

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

Names and synonyms

1 names

2-Pyrimidinamine,4,5-dichloro-(9ci)

Work with 4,5-Dichloropyrimidin-2-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

2-Amino-4-chloro-5-fluoropyrimidine1683-75-664 % similar 5-Bromo-4-chloropyrimidin-2-amine1044767-99-859 % similar 2,3,5,6-Tetrachloropyridine2402-79-142 % similar 4-Chloro-1H-pyrazolo[3,4-D]pyrimidin-6-amine100644-65-340 % similar 2-Amino-4,5-dichloropyridine188577-68-640 % similar 2-Amino-4-chloropyrimidine3993-78-039 % similar 2,4-Dichloropyridin-3-amine173772-63-938 % similar 5-Chlorouracil1820-81-138 % similar

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

Same formula

2,6-Dichloro-4-pyrimidinamine10132-07-7 5,6-Dichloropyrimidin-4-amine310400-38-5 5-Amino-4,6-dichloropyrimidine5413-85-4 4,6-Dichloro-2-pyrimidinamine56-05-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook