847685-85-2
4-[[2-CHLORO-4-[(4-METHYL-2-NITROPHENYL)AZO]PHENYL]AZO]-2-METHYL-BENZENAMINE
Name4-[[2-CHLORO-4-[(4-METHYL-2-NITROPHENYL)AZO]PHENYL]AZO]-2-METHYL-BENZENAMINE
1Identification
【Name】
4-[[2-CHLORO-4-[(4-METHYL-2-NITROPHENYL)AZO]PHENYL]AZO]-2-METHYL-BENZENAMINE
【CAS】
【MDL】
MFCD09839573
【English Synonyms】
【Formula】
C20 H17 Cl N6 O2
【MolWeight】
408.847
【Inchi】
InChI=1S/C20H17ClN6O2/c1-12-3-7-19(20(9-12)27(28)29)26-24-15-5-8-18(16(21)11-15)25-23-14-4-6-17(22)13(2)10-14/h3-11H,22H2,1-2H3/b25-23+,26-24+
【InChIKey】
InChIKey=WAZYKBLKWZGDKN-OGGGYYITSA-N
【SMILES】
Cc1ccc(c(c1)[N+](=O)[O-])/N=N/c2ccc(c(c2)Cl)/N=N/c3ccc(c(c3)C)N
【MOL File】
4-[[2-CHLORO-4-[(4-M….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[[2-CHLORO-4-[(4-METHYL-2-NITROPHENYL)AZO]PHENYL]AZO]-2-METHYL-BENZENAMINE.cml