939040-19-4
4-CHLORO-6-(2-METHYLPHENYL)-5-NITRO-PYRIMIDINE
Name4-CHLORO-6-(2-METHYLPHENYL)-5-NITRO-PYRIMIDINE
1Identification
【Name】
4-CHLORO-6-(2-METHYLPHENYL)-5-NITRO-PYRIMIDINE
【CAS】
【MDL】
MFCD13192008
【English Synonyms】
【Formula】
C11 H8 Cl N3 O2
【MolWeight】
249.656
【Inchi】
InChI=1S/C11H8ClN3O2/c1-7-4-2-3-5-8(7)9-10(15(16)17)11(12)14-6-13-9/h2-6H,1H3
【InChIKey】
InChIKey=WIYFOOHSRWIXIS-UHFFFAOYSA-N
【SMILES】
Cc1ccccc1c2c(c(ncn2)Cl)[N+](=O)[O-]
【MOL File】
4-CHLORO-6-(2-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-CHLORO-6-(2-METHYLPHENYL)-5-NITRO-PYRIMIDINE.cml