769148-79-0
1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
Name1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD05154126
【English Synonyms】
【Formula】
C26 H17 Cl2 N3 O4
【MolWeight】
506.343
【Inchi】
InChI=1S/C26H17Cl2N3O4/c27-17-11-12-20(22(28)14-17)26(34)35-23-13-10-16-6-4-5-9-19(16)21(23)15-29-31-25(33)24(32)30-18-7-2-1-3-8-18/h1-15H,(H,30,32)(H,31,33)/b29-15+
【InChIKey】
InChIKey=BLTPYVRFFVEZFC-WKULSOCRSA-N
【SMILES】
c1ccc(cc1)NC(=O)C(=O)N/N=C/c2c3ccccc3ccc2OC(=O)c4ccc(cc4Cl)Cl
【MOL File】
1-(2-(ANILINO(OXO)AC….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE.cml