Cas no 437-50-3 (Gentisin)

Gentisin structure
Gentisin structure
Product Name:Gentisin
CAS No:437-50-3
MF:C14H10O5
MW:258.226204395294
MDL:MFCD00075947
CID:329420
PubChem ID:5281636
Update Time:2025-04-19

Gentisin Chemical and Physical Properties

Names and Identifiers

    • 9H-Xanthen-9-one,1,7-dihydroxy-3-methoxy-
    • 1,7-dihydroxy-3-methoxyxanthen-9-one
    • 1,7-dihydroxy-3-methoxy-9H-xanthen-9-one
    • 1,7-Dihydroxy-3-methoxy-xanthen-9-on
    • 1,7-dihydroxy-3-methoxy-xanthen-9-one
    • 1,7-Dihydroxy-3-methoxy-xanthon
    • 1,7-Dihydroxy-3-methoxyxanthone
    • EINECS 207-114-1
    • GENTIANIC ACID
    • Gentianin
    • Gentisine
    • Xanthen-9-one,1,7-dihydroxy-3-methoxy
    • Gentisin
    • 9H-Xanthen-9-one, 1,7-dihydroxy-3-methoxy-
    • 4,7-Dihydroxy-2-methoxyxanthone
    • K57MOP2HM0
    • Xanthen-9-one, 1,7-dihydroxy-3-methoxy-
    • Gentianin?
    • BCP17139
    • M
    • A
    • CHEMBL3093478
    • CHEBI:5324
    • GENTISIN [MI]
    • UNII-K57MOP2HM0
    • FT-0757753
    • Gentiin
    • SCHEMBL996402
    • CCRIS 3151
    • NS00031362
    • BRN 0384788
    • Q27106720
    • 1,7-Dihydroxy-3-methoxyxanthone; 1,7-Dihydroxy-3-methoxyxanthen-9-one
    • MFCD00075947
    • DTXSID20195907
    • A1-01883
    • CS-0032629
    • DTXCID20118398
    • MS-23634
    • 437-50-3
    • AKOS024258078
    • HY-N4279
    • 1,7-dihydroxy-3-methoxyanthone
    • ConMedNP.1630
    • XOXYHGOIRWABTC-UHFFFAOYSA-N
    • A11259
    • DA-63740
    • BDBM50611835
    • MDL: MFCD00075947
    • Inchi: 1S/C14H10O5/c1-18-8-5-10(16)13-12(6-8)19-11-3-2-7(15)4-9(11)14(13)17/h2-6,15-16H,1H3
    • InChI Key: XOXYHGOIRWABTC-UHFFFAOYSA-N
    • SMILES: O1C2C=CC(=CC=2C(C2C(=CC(=CC1=2)OC)O)=O)O
    • BRN: 0384788

Computed Properties

  • Exact Mass: 258.05300
  • Monoisotopic Mass: 258.05282342 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 1
  • Complexity: 358
  • 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
  • Molecular Weight: 258.23
  • XLogP3: 2.8
  • Topological Polar Surface Area: 76

Experimental Properties

  • Color/Form: Yellow powder
  • Density: 1.480±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 297-299 °C (decomposition)
  • Boiling Point: 361.48°C (rough estimate)
  • Flash Point: 205.2±23.6 °C
  • Refractive Index: 1.4825 (estimate)
  • Solubility: Insuluble (1.0E-3 g/L) (25 oC),
  • PSA: 79.90000
  • LogP: 2.36600
  • Vapor Pressure: 0.0±1.4 mmHg at 25°C

Gentisin Security Information

Gentisin Customs Data

  • HS CODE:2932999099
  • Customs Data:

    China Customs Code:

    2932999099

    Overview:

    2932999099. Other heterocyclic compounds containing only oxygen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Gentisin Pricemore >>

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