酸性棕 H

pro_cas
6487-04-3
pro_cdbregno
CCD08275938
pro_formula
C28 H16 N8 O14 S2 . 2 Na
pro_molWeight
798.588

basic_info

Product_Name: 酸性棕 H
CAS: 6487-04-3
中文同义词: 酸性棕 H
EnglishSynonyms: DISODIUM 5-[[2,4-DIHYDROXY-3-[(2-HYDROXY-5-NITROPHENYL)AZO]PHENYL]AZO]-4-HYDROXY-3-[(4-NITROPHENYL)AZO]NAPHTHALENE-2,7-DISULPHONATE ; CI ACID BROWN 121 ; ACID BROWN 121
pro_mdlNumber: MFCD23160437
pro_acceptors: 22
pro_donors: 4
pro_smile: c1cc(ccc1/N=N/c2c(cc3cc(cc(c3c2O)/N=N/c4ccc(c(c4O)/N=N/c5cc(ccc5O)[N+](=O)[O-])O)S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+]
InChi: InChI=1S/C28H18N8O14S2.2Na/c37-21-7-5-16(36(43)44)11-19(21)31-33-25-22(38)8-6-18(27(25)39)30-32-20-12-17(51(45,46)47)9-13-10-23(52(48,49)50)26(28(40)24(13)20)34-29-14-1-3-15(4-2-14)35(41)42;;/h1-12,37-40H,(H,45,46,47)(H,48,49,50);;/q;2*+1/p-2/b32-30+,33-31+,34-29+;;
InChiKey: InChIKey=OJFUEILETDLNQK-YNVLCFGRSA-L

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