767330-19-8
4-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
Name4-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
4-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD06068321
【English Synonyms】
【Formula】
C22 H16 Cl2 N2 O3
【MolWeight】
427.285
【Inchi】
InChI=1S/C22H16Cl2N2O3/c1-14-4-2-3-5-18(14)21(27)26-25-13-15-6-9-17(10-7-15)29-22(28)19-11-8-16(23)12-20(19)24/h2-13H,1H3,(H,26,27)/b25-13+
【InChIKey】
InChIKey=IBWWOXCXIODIHW-DHRITJCHSA-N
【SMILES】
Cc1ccccc1C(=O)N/N=C/c2ccc(cc2)OC(=O)c3ccc(cc3Cl)Cl
【MOL File】
4-(2-(2-METHYLBENZOY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE.cml