Cas no 326491-79-6 ((1R)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol)

(1R)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol structure
326491-79-6 structure
Product Name:(1R)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol
CAS No:326491-79-6
MF:C10H14O4
MW:198.215763568878
CID:1065133
PubChem ID:11183213
Update Time:2025-04-20

(1R)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol Chemical and Physical Properties

Names and Identifiers

    • (1R)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol
    • (1R)-1-(3,4-DIMETHOXYPHENYL)-1,2-ETHANEDIOL,WHITE SOLID
    • (1S)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol
    • (1R)-1-(3,4-dimethoxyphenyl)ethane-1,2-diol
    • SCHEMBL22785859
    • 326491-79-6
    • DB-289639
    • Inchi: 1S/C10H14O4/c1-13-9-4-3-7(8(12)6-11)5-10(9)14-2/h3-5,8,11-12H,6H2,1-2H3/t8-/m0/s1
    • InChI Key: KFMXFWBXSCYUCM-QMMMGPOBSA-N
    • SMILES: O[C@@H](CO)C1C=CC(=C(C=1)OC)OC

Computed Properties

  • Exact Mass: 198.08900
  • Monoisotopic Mass: 198.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 162
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0
  • Topological Polar Surface Area: 58.9?2

Experimental Properties

  • PSA: 58.92000
  • LogP: 0.72950

(1R)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol Pricemore >>

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(1R)-1-(3,4-Dimethoxyphenyl)-1,2-ethanediol Production Method

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