5863-53-6
FAST ACID VIOLET 10B
Name
FAST ACID VIOLET 10B
pro_formula
C32 H35 N3 O3 S . C32 H34 N3 O6 S2 . Na
pro_molWeight
1185.47
1Identification
【Name】
FAST ACID VIOLET 10B
【CAS】
【MDL】
MFCD00166979
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C32 H35 N3 O3 S . C32 H34 N3 O6 S2 . Na
【pro_molWeight】
1185.47
【Inchi】
InChI=1S/C32H35N3O6S2.C32H35N3O3S.Na/c1-6-35(22-23-8-7-9-29(20-23)42(36,37)38)28-18-19-30(31(21-28)43(39,40)41)32(24-10-14-26(15-11-24)33(2)3)25-12-16-27(17-13-25)34(4)5;1-6-35(23-24-8-7-9-31(22-24)39(36,37)38)30-20-14-27(15-21-30)32(25-10-16-28(17-11-25)33(2)3)26-12-18-29(19-13-26)34(4)5;/h7-21H,6,22H2,1-5H3,(H-,36,37,38,39,40,41);7-22H,6,23H2,1-5H3;/q;;+1/p-1
【InChIKey】
InChIKey=OZXIMWDYPYYWFS-UHFFFAOYSA-M
【SMILES】
CCN(Cc1cccc(c1)S(=O)(=O)[O-])c2ccc(cc2)C(=C3C=CC(=[N+](C)C)C=C3)c4ccc(cc4)N(C)C.CCN(Cc1cccc(c1)S(=O)(=O)[O-])c2ccc(c(c2)S(=O)(=O)[O-])C(=C3C=CC(=[N+](C)C)C=C3)c4ccc(cc4)N(C)C.[Na+]
【MOL File】
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:9
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
FAST ACID VIOLET 10B.cml
quick_release
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