Cas no 57548-58-0 ((o-Methylphenoxy)acetic acid sodium salt)

(o-Methylphenoxy)acetic acid sodium salt structure
57548-58-0 structure
Product Name:(o-Methylphenoxy)acetic acid sodium salt
CAS No:57548-58-0
MF:C9H9NaO3
MW:188.155733823776
CID:344981
Update Time:2023-08-02

(o-Methylphenoxy)acetic acid sodium salt Chemical and Physical Properties

Names and Identifiers

    • Acetic acid, (2-methylphenoxy)-, sodium salt
    • (o-Methylphenoxy)acetic acid sodium salt
    • Cambridge id 5117234
    • Inchi: 1S/C9H10O3.Na/c1-7-4-2-3-5-8(7)12-6-9(10)11;/h2-5H,6H2,1H3,(H,10,11);/q;+1/p-1
    • InChI Key: HKNMVNAPCMXVTR-UHFFFAOYSA-M
    • SMILES: [Na+].O(CC(=O)[O-])C1C=CC=CC=1C

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 161
  • Topological Polar Surface Area: 49.4
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