Cas no 116022-18-5 (Methyl 4-chloro-3-methoxybenzoate)

Methyl 4-chloro-3-methoxybenzoate structure
116022-18-5 structure
Product Name:Methyl 4-chloro-3-methoxybenzoate
CAS No:116022-18-5
MF:C9H9ClO3
MW:200.618962049484
MDL:MFCD02683861
CID:1082018
PubChem ID:44886974
Update Time:2025-04-20

Methyl 4-chloro-3-methoxybenzoate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-chloro-3-methoxybenzoate
    • benzoic acid, 4-chloro-3-methoxy-, methyl ester
    • LogP
    • 4-CHLORO-3-METHOXY-BENZOIC ACID METHYL ESTER
    • Methyl4-chloro-3-methoxybenzoate
    • DA-32473
    • DTXSID10661247
    • CS-0061927
    • AKOS022173223
    • AS-19681
    • Methyl 4-Chloro-3-Methoxy Benzoate
    • MFCD02683861
    • SCHEMBL2253933
    • XOSUADSADIJLGO-UHFFFAOYSA-N
    • methyl 4-chloro-3-(methyloxy)benzoate
    • 116022-18-5
    • SY240574
    • MDL: MFCD02683861
    • Inchi: 1S/C9H9ClO3/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5H,1-2H3
    • InChI Key: XOSUADSADIJLGO-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(C(=O)OC)=CC=1OC

Computed Properties

  • Exact Mass: 200.02407
  • Monoisotopic Mass: 200.0240218g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 184
  • 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
  • XLogP3: 2.6
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • Melting Point: 58-59°C
  • PSA: 35.53

Methyl 4-chloro-3-methoxybenzoate Security Information

Methyl 4-chloro-3-methoxybenzoate Pricemore >>

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