Chem
J-GLOBAL ID:200907017286935354   Nikkaji number:J86.116B

Eriochrome Cyanine R

エリオクロムシアニンR
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C23H15Na3O7[O-]2[S+2]
Molecular formula furigana: C23-H15-NA3-O9-S
Molecular weight: 536.390
InChI: InChI=1S/C23H18O9S.3Na/c1-11-7-13(9-15(19(11)24)21(26)27)23(14-8-12(2)20(25)16(10-14)22(28)29)17-5-3-4-6-18(17)33(30,31)32-23;;;/h3-10,24-25H,1-2H3,(H,26,27)(H,28,29);;;/q;3*+1/p-3
InChI key: PHMYVLMZEKQMML-UHFFFAOYSA-K
SMILES: Cc1cc(cc(C(=O)O[Na])c1O)C1(O[S+2]([O-])([O-])c2ccccc12)c1cc(C)c(O[Na])c(c1)C(=O)O[Na]
Systematic name  (3):
  • 3-[4-ヒドロキシ-3-メチル-5-(ソジオオキシカルボニル)フェニル]-3-[4-(ソジオオキシ)-3-メチル-5-(ソジオオキシカルボニル)フェニル]-3H-2,1-ベンゾオキサチオール1,1-ジオキシド
  • 3-{4-ヒドロキシ-3-メチル-5-[(ソジオオキシ)カルボニル]フェニル}-3-[3-メチル-4-(ソジオオキシ)-5-[(ソジオオキシ)カルボニル]フェニル]-1,3-ジヒドロ-2,1-ベンゾオキサチオール-1,1-ジイウム-1,1-ビス(オラート)
  • 3-{4-hydroxy-3-methyl-5-[(sodiooxy)carbonyl]phenyl}-3-[3-methyl-4-(sodiooxy)-5-[(sodiooxy)carbonyl]phenyl]-1,3-dihydro-2,1-benzoxathiole-1,1-diium-1,1-bis(olate)
Other name (32):
  • C.I.モルダントブルー3
  • アトランチクロムシアニンRA
  • アリザロールシアニンRC
  • ポンタクロムブルーECR
  • オメガクロムシアニンGR
Show all
CAS registry number: 3564-18-9
Regulation number (3):
  • (5)-2083
  • EINECS2226417
  • TSCA(3564-18-9)
Application (1):
analytical reagent
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