InChI=1S/C18H18N4O6S4/c1-3-21-13-7-5-11(31(23,24)25)9-15(13)29-17(21)19-20-18-22(4-2)14-8-6-12(32(26,27)28)10-16(14)30-18/h5-10H,3-4H2,1-2H3,(H,23,24,25)(H,26,27,28)/b19-17-,20-18+

【InChIKey】

InChIKey=ZTOJFFHGPLIVKC-YAFCTCPESA-N

【SMILES】

CCn\1c2ccc(cc2s/c1=N\N=c\3/n(c4ccc(cc4s3)S(=O)(=O)O)CC)S(=O)(=O)O

【MOL File】

ABTS.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:2

H bond acceptor:10

XLogP3:0.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

【WGK Germany】

4CML File

ABTS.cml

Quick Release

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28752-68-3 ABTS

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】