Cas no 15548-60-4 ((2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol)

(2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol structure
15548-60-4 structure
Product Name:(2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol
CAS No:15548-60-4
MF:C14H15BrClNO6
MW:408.629002809525
MDL:MFCD00063690
CID:50136
PubChem ID:354334971
Update Time:2025-04-18

(2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol Chemical and Physical Properties

Names and Identifiers

    • 5-Bromo-4-chloro-3-indolyl-beta-D-glucoside
    • 5-Bromo-4-chloro-3-indolyl-beta-D-glucopyranoside
    • X-Glc
    • X-glucoside
    • 5-Bromo-4-chloro-3-indolyl beta-D-Glucopyranoside
    • 5-BROMO-4-CHLORO-3-INDOLYLB-D-GLUCOPYRAN OSIDE
    • X-beta-D-Glc
    • (+-)-5-(3,4-Dihydroxy-benzyl)-dihydro-furan-2-on
    • (+-)-5-(3,4-dihydroxy-benzyl)-dihydro-furan-2-one
    • -<small>D<
    • 5-(3,4-dihydroxybenzyl)dihydrofuran-2(3H)-one
    • 5-(3,4-dihydroxy-benzyl)-dihydro-furan-2-one
    • AC1L48C9
    • CHEMBL181193
    • LS-70520
    • LU5167200
    • NIOSH
    • SureCN5088840
    • Tetrahydro-5-(3,4-dihydroxybenzyl)-2-furanone
    • 5-Bromo-4-chloro-3-(β-D-glucopyranosyloxy)indole
    • Indole,5-bromo-4-chloro-3-(b-D-glucopyranosyloxy)- (7CI,8CI)
    • 4-Chloro-5-bromo-3-indolyl-b-D-glucoside
    • 5-Bromo-4-chloro-3-indolyl b-D-glucoside
    • 5-Bromo-4-chloro-3-indolyl b-D-glucopyranoside
    • EINECS 239-603-0
    • 5-bromo-4-chloro-3-indolyl beta-d-glucoside
    • A809649
    • (2S,3R,4S,5S,6R)-2-(5-bromo-4-chloro-1H-indol-3-yloxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • 5-bromo-4-chloro-3-indolyl
    • SCHEMBL152361
    • AKOS016016043
    • 5-bromo-4-chloro-1H-indol-3-yl beta-D-glucopyranoside
    • 5-Bromo-4-chloro-3-indoxylglucoside
    • A-D-glucoside
    • AS-11177
    • 5-Bromo-4-chloro-3-indolyl beta -D-glucopyranoside
    • (2S,3R,4S,5S,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    • CS-0141886
    • 5-bromo-4-chloro-3-indolyl--d-glucoside
    • CHEBI:75424
    • 5-bromo-4-chloro-3-indolyl beta-glucoside
    • MFCD00063690
    • beta-D-Glucopyranoside, 5-bromo-4-chloro-1H-indol-3-yl
    • (-)-5-BROMO-4-CHLORO-3-INDOLYL BETA-D-GLUCOSIDE
    • A-D-glucopyranoside
    • DTXSID701245955
    • 5-Bromo-4-chloroindol-3-yl-beta-D-glucopyranoside
    • Indoxyl-Glucoside
    • (-)-5-bromo-4-chloro-3-indolyl-beta-D-glucoside
    • HY-137779
    • 5-Br-4-Cl-3-indoxyl-alpha-D-glucoside
    • 5-bromo-4-chloro-3-indolyl-beta-glucoside
    • 15548-60-4
    • (2S,3R,4S,5S,6R)-2-((5-Bromo-4-chloro-1H-indol-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
    • 5-Bromo-4-chloro-3-indolyl beta-D-glucopyranoside, >=97%
    • Q27145297
    • 5-Bromo-4-chloro-3-indolyl I(2)-D-glucopyranoside
    • 5-Bromo-4-chloro-3-indoxyl-beta-D-glucopyranoside
    • OPIFSICVWOWJMJ-LNNRFACYSA-N
    • (2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol
    • MDL: MFCD00063690
    • Inchi: 1S/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11-,12+,13-,14-/m1/s1
    • InChI Key: OPIFSICVWOWJMJ-LNNRFACYSA-N
    • SMILES: BrC1C=CC2=C(C=1Cl)C(=CN2)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O

Computed Properties

  • Exact Mass: 406.977
  • Monoisotopic Mass: 406.977
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 3
  • Complexity: 421
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 5
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 115

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.882
  • Melting Point: 243°C(lit.)
  • Boiling Point: 673.9 °C at 760 mmHg
  • Flash Point: 361.3 °C
  • Refractive Index: 1.731
  • Solubility: DMF: 50?mg/mL, clear, colorless to very faintly yellow
  • PSA: 115.17000
  • LogP: 0.76250
  • Specific Rotation: -81 o (c=1, DMF)
  • Solubility: Not determined

(2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol Security Information

  • WGK Germany:3
  • Safety Instruction: S24/25
  • FLUKA BRAND F CODES:8-10-21
  • Storage Condition:-20°C
  • Safety Term:S24/25

(2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol Customs Data

  • HS CODE:29389090

(2S,3R,4S,5S,6R)-2-(5-Bromo-4-chloro-1H-indol-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol Pricemore >>

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Purity:98%
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Tiancheng Chemical (Jiangsu) Co., Ltd
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(CAS:15548-60-4)5-Bromo-4-chloro-3-indolylβ-D-Glucopyranoside
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Quantity:25KG,200KG,1000KG
Purity:99%
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NewCan Biotech Limited
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(CAS:15548-60-4)5-Bromo-4-chloroindol-3-yl-beta-D-glucopyranoside
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