764656-80-6
1-(2-(CYCLOHEXYLCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
Name1-(2-(CYCLOHEXYLCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
1Identification
【Name】
1-(2-(CYCLOHEXYLCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154594
【English Synonyms】
【Formula】
C27 H28 N2 O5
【MolWeight】
460.527
【Inchi】
InChI=1S/C27H28N2O5/c1-32-24-15-13-20(16-25(24)33-2)27(31)34-23-14-12-18-8-6-7-11-21(18)22(23)17-28-29-26(30)19-9-4-3-5-10-19/h6-8,11-17,19H,3-5,9-10H2,1-2H3,(H,29,30)/b28-17+
【InChIKey】
InChIKey=XVBLJVBLYWJXGW-OGLMXYFKSA-N
【SMILES】
COc1ccc(cc1OC)C(=O)Oc2ccc3ccccc3c2/C=N/NC(=O)C4CCCCC4
【MOL File】
1-(2-(CYCLOHEXYLCARB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(CYCLOHEXYLCARBONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE.cml