5009-83-6
4-HYDROXY-2-O-TOLYLPHTHALAZINIUM HYDROXIDE, INNER SALT
Name4-HYDROXY-2-O-TOLYLPHTHALAZINIUM HYDROXIDE, INNER SALT
pro_formulaC15 H12 N2 O3 S
1Identification
【Name】
4-HYDROXY-2-O-TOLYLPHTHALAZINIUM HYDROXIDE, INNER SALT
【CAS】
【MDL】
MFCD18427108
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C15 H12 N2 O3 S
【pro_molWeight】
300.337
【Inchi】
InChI=1S/C15H12N2O3S/c1-11-6-2-5-9-14(11)21(19,20)17-10-12-7-3-4-8-13(12)15(18)16-17/h2-10H,1H3
【InChIKey】
InChIKey=UDIRMPBEASGGQU-UHFFFAOYSA-N
【SMILES】
Cc1ccccc1S(=O)(=O)[n+]2cc3ccccc3c(n2)[O-]
【MOL File】
4-HYDROXY-2-O-TOLYLP….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:5
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4-HYDROXY-2-O-TOLYLPHTHALAZINIUM HYDROXIDE, INNER SALT.cml