Cas no 100786-01-4 (Cianidanol)

Cianidanol structure
Cianidanol structure
Product Name:Cianidanol
CAS No:100786-01-4
MF:C15H14O6
MW:290.268064975739
CID:170184
Update Time:2023-08-03

Cianidanol Chemical and Physical Properties

Names and Identifiers

    • C.I. Natural Brown 3
    • 75250
    • (+)-catechin
    • Cianidanol
    • CATECHIN
    • Catechuic acid
    • Cyanidanol
    • D-Catechin
    • Catechinic acid
    • Catergen
    • (+)-Cyanidanol
    • (+)-Catechol
    • Cianidol
    • (+)-Cyanidan-3-ol
    • Biocatechin
    • (+)-Catechin Hydrate
    • D-(+)-Catechin
    • D-Catechol
    • Dexcyanidanol
    • Catechin (flavan)
    • Catechol (flavan)
    • (2R,3S)-Catechin
    • (2R,3S)-2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol
    • Gambier
    • 3-Cyanidanol, (+)-
    • (2R,3S)-(+)-Catechin
    • Cianidanolum
    • Catechu
    • Transepar
    • Katha
    • Cutch (dye)
    • (+)-Cianidanol
    • 3,3',4',5,7-Flavanpentol
    • (+)-Cyanidanol-3
    • CCRI
    • Inchi: 1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1
    • InChI Key: PFTAWBLQPZVEMU-DZGCQCFKSA-N
    • SMILES: O1C2C=C(C=C(C=2C[C@@H]([C@H]1C1C=CC(=C(C=1)O)O)O)O)O

Computed Properties

  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 1
  • Complexity: 364
  • XLogP3: 0.4
  • Topological Polar Surface Area: 110
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