101002-13-5
2-(N-((ANILINOCARBONYL)OXY)HEXANIMIDOYL)-1-HYDROXY-4-METHYLBENZENE
Name2-(N-((ANILINOCARBONYL)OXY)HEXANIMIDOYL)-1-HYDROXY-4-METHYLBENZENE
1Identification
【Name】
2-(N-((ANILINOCARBONYL)OXY)HEXANIMIDOYL)-1-HYDROXY-4-METHYLBENZENE
【CAS】
【MDL】
MFCD01103060
【English Synonyms】
【Formula】
C20 H24 N2 O3
【MolWeight】
340.421
【Inchi】
InChI=1S/C20H24N2O3/c1-3-4-6-11-18(17-14-15(2)12-13-19(17)23)22-25-20(24)21-16-9-7-5-8-10-16/h5,7-10,12-14,23H,3-4,6,11H2,1-2H3,(H,21,24)/b22-18+
【InChIKey】
InChIKey=MKQNSTGKLDXAMG-RELWKKBWSA-N
【SMILES】
CCCCC/C(=N\OC(=O)Nc1ccccc1)/c2cc(ccc2O)C
【MOL File】
2-(N-((ANILINOCARBON….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(N-((ANILINOCARBONYL)OXY)HEXANIMIDOYL)-1-HYDROXY-4-METHYLBENZENE.cml