6-Chloro-2,4-Pyrimidinediamine

Molecule SVG Image

Properties Simple | Detailed

Formula C4H5ClN4
IUPAC Name 6-chloropyrimidine-2,4-diamine
Molecular Mass 144.562 g·mol−1
Heat of Formation 95.0 ± 16.7 kJ·mol−1
Dipole Moment 3.68 ± 1.08 D
Volume 150.47 Å 3
Surface Area 159.05 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry Cs
Synonyms
  • (2-amino-6-chloro-pyrimidin-4-yl)amine
  • 2,4-pyrimidinediamine, 6-chloro-
  • 2,6-diamino-4-chloropyrimidine
  • 4-chloro-2,6-diamino pyrimidine
  • 4-chloro-2,6-diaminopyrimidine
  • 6-chloro-2,4-diaminopyrimidine
  • ae-861/30098081
CAS Number(s)
  • 156-83-2
InChIKey QJIUMVUZDYPQRT-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C Cl N