Cas no 27613-78-1 (Anthracenesulfonicacid, 9,10-dihydro-1,2-dihydroxy-9,10-dioxo- (8CI,9CI))

Anthracenesulfonicacid, 9,10-dihydro-1,2-dihydroxy-9,10-dioxo- (8CI,9CI) structure
27613-78-1 structure
Product Name:Anthracenesulfonicacid, 9,10-dihydro-1,2-dihydroxy-9,10-dioxo- (8CI,9CI)
CAS No:27613-78-1
MF:C14H8O7S
MW:320.274123191834
CID:254413
PubChem ID:8534
Update Time:2025-04-19

Anthracenesulfonicacid, 9,10-dihydro-1,2-dihydroxy-9,10-dioxo- (8CI,9CI) Chemical and Physical Properties

Names and Identifiers

    • Anthracenesulfonicacid, 9,10-dihydro-1,2-dihydroxy-9,10-dioxo- (8CI,9CI)
    • 1,2-DIHYDROXYANTHRAQUINONE-3-SULFONIC ACID
    • 9,10-dihydro-1,2-dihydroxy-9,10-dioxoAnthracenesulfonic acid
    • ALIZARIN-3-SULFONIC ACID
    • CHEMBL1206015
    • 3,4-Dihydroxy-9,10-anthraquinone-2-sulfonic acid
    • Ahcoquinone Red S
    • Alizarine Red Indicator
    • CHEBI:40863
    • Q27104468
    • Az-R
    • BDBM50460640
    • 9,10-Dihydro-3,4-dihydroxy-9,10-dioxo-2-anthracenesulfonic acid
    • Chrome Red Alizarine
    • 3,4-Dihydroxy-2-anthraquinonesulfonic acid
    • NCI60_041718
    • ARS
    • PIN-077
    • Alizarine Red WA
    • Acid Red Alizarine
    • Alizarine Red S
    • 1oar
    • Oxanal Fast Red SW
    • Diamond Red W
    • Calcochrome Alizarine Red SC
    • 1,2-Dihydroxy-3-sulfonate-9,10-anthraquinone
    • UNII-9A6LXA99ML
    • 3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonicacid
    • 27613-78-1
    • NSC7796
    • 3,4-dihydroxy-9,10-dioxoanthracene-2-sulfonic acid
    • 9A6LXA99ML
    • 1,2-Dihydroxy-3-sulfoanthraquinone
    • Alizarine Red SZ
    • EN300-175290
    • Alizarine Red A
    • 3,4-Dihydroxy-9,10-dioxo-2-anthracenesulfonic acid
    • Alizarine Red WS
    • Sodium alizarinsulfonate
    • 3,4-dihydroxy-9,10-dioxo-anthracene-2-sulfonic acid
    • Alizarine Red AS
    • SCHEMBL1203855
    • Carnelio Rubine Lake
    • Alizarine Carmine Indicator
    • Alizarin S
    • 3-Alizarinsulfonic acid
    • Alizarin Red S free acid
    • 3,4-dihydroxyanthraquinone-2-sulfonic acid
    • Alizarine Red S sodium salt
    • Sodium alizarin-3-sulfonate
    • 2-Anthracenesulfonic acid, 9,10-dihydro-3,4-dihydroxy-9,10-dioxo-
    • 2-Anthraquinonesulfonic acid, 3,4-dihydroxy-
    • 3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid
    • Alizarin Carmine
    • C.I. Mordant Red 3
    • Alizarine S Extra Pure A
    • DTXSID0052754
    • Alizarine Red SW
    • Mitsui Alizarine Red S
    • Fenakrom Red W
    • Epitope ID:116192
    • Alizarine Red W
    • 83-61-4
    • Inchi: 1S/C14H8O7S/c15-11-6-3-1-2-4-7(6)12(16)10-8(11)5-9(22(19,20)21)13(17)14(10)18/h1-5,17-18H,(H,19,20,21)
    • InChI Key: JKYKXTRKURYNGW-UHFFFAOYSA-N
    • SMILES: S(C1C(=C(C2C(C3C=CC=CC=3C(C=2C=1)=O)=O)O)O)(=O)(=O)O

Computed Properties

  • Exact Mass: 319.99900
  • Monoisotopic Mass: 319.99907376g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 1
  • Complexity: 593
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 137?2

Experimental Properties

  • PSA: 137.35000
  • LogP: 2.20070
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