500302-48-7
6-CHLORO-N4-(4-METHYLPHENETHYL)PYRIMIDINE-4,5-DIAMINE
Name6-CHLORO-N4-(4-METHYLPHENETHYL)PYRIMIDINE-4,5-DIAMINE
1Identification
【Name】
6-CHLORO-N4-(4-METHYLPHENETHYL)PYRIMIDINE-4,5-DIAMINE
【CAS】
【MDL】
MFCD20229331
【English Synonyms】
【Formula】
C13 H15 Cl N4
【MolWeight】
262.742
【Inchi】
InChI=1S/C13H15ClN4/c1-9-2-4-10(5-3-9)6-7-16-13-11(15)12(14)17-8-18-13/h2-5,8H,6-7,15H2,1H3,(H,16,17,18)
【InChIKey】
InChIKey=QAMBRHGPUZVFRU-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)CCNc2c(c(ncn2)Cl)N
【MOL File】
6-CHLORO-N4-(4-METHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-CHLORO-N4-(4-METHYLPHENETHYL)PYRIMIDINE-4,5-DIAMINE.cml