765912-75-2
1-(2-((4-CL-PH)SULFONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
Name1-(2-((4-CL-PH)SULFONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
FormulaC26 H21 Cl N2 O6 S
1Identification
【Name】
1-(2-((4-CL-PH)SULFONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
【CAS】
【MDL】
MFCD06199786
【English Synonyms】
【Formula】
C26 H21 Cl N2 O6 S
【MolWeight】
524.979
【Inchi】
InChI=1S/C26H21ClN2O6S/c1-33-24-14-8-18(15-25(24)34-2)26(30)35-23-13-7-17-5-3-4-6-21(17)22(23)16-28-29-36(31,32)20-11-9-19(27)10-12-20/h3-16,29H,1-2H3/b28-16+
【InChIKey】
InChIKey=JKWZYWGARGZSHY-LQKURTRISA-N
【SMILES】
COc1ccc(cc1OC)C(=O)Oc2ccc3ccccc3c2/C=N/NS(=O)(=O)c4ccc(cc4)Cl
【MOL File】
1-(2-((4-CL-PH)SULFO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-((4-CL-PH)SULFONYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE.cml