767332-83-2
4-BROMO-2-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE
Name4-BROMO-2-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE
1Identification
【Name】
4-BROMO-2-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE
【CAS】
【MDL】
MFCD06199625
【English Synonyms】
【Formula】
C23 H19 Br N2 O3
【MolWeight】
451.318
【Inchi】
InChI=1S/C23H19BrN2O3/c1-15-7-3-5-9-19(15)22(27)26-25-14-17-13-18(24)11-12-21(17)29-23(28)20-10-6-4-8-16(20)2/h3-14H,1-2H3,(H,26,27)/b25-14+
【InChIKey】
InChIKey=BEKXCFZESPAYLJ-AFUMVMLFSA-N
【SMILES】
Cc1ccccc1C(=O)N/N=C/c2cc(ccc2OC(=O)c3ccccc3C)Br
【MOL File】
4-BROMO-2-(2-(2-METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BROMO-2-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-METHYLBENZOATE.cml