Cas no 230301-81-2 (methyl 3-fluoro-2-methylbenzoate)

methyl 3-fluoro-2-methylbenzoate structure
230301-81-2 structure
Product Name:methyl 3-fluoro-2-methylbenzoate
CAS No:230301-81-2
MF:C9H9FO2
MW:168.164966344833
MDL:MFCD06203865
CID:1412863
PubChem ID:21752566
Update Time:2025-09-28

methyl 3-fluoro-2-methylbenzoate Chemical and Physical Properties

Names and Identifiers

    • methyl 3-fluoro-2-methylbenzoate
    • benzoic acid, 3-fluoro-2-methyl-, methyl ester
    • LogP
    • 3-fluoro-2-methyl-benzoic acid methyl ester
    • ZNIXEVSMQRBBEM-UHFFFAOYSA-N
    • AS-80716
    • CS-0193954
    • BENZOIC ACID,3-FLUORO-2-METHYL-,METHYL ESTER
    • AKOS006294980
    • SCHEMBL5334254
    • methyl3-fluoro-2-methylbenzoate
    • 230301-81-2
    • MFCD06203865
    • SB35640
    • DA-43140
    • DTXSID10617709
    • MDL： MFCD06203865
    • Inchi： 1S/C9H9FO2/c1-6-7(9(11)12-2)4-3-5-8(6)10/h3-5H,1-2H3
    • InChI Key： ZNIXEVSMQRBBEM-UHFFFAOYSA-N
    • SMILES： FC1=CC=CC(C(=O)OC)=C1C

Computed Properties

  • Exact Mass: 168.05867
  • Monoisotopic Mass: 168.05865769g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 170
  • 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: 2.2
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Density: 1.137
  • Boiling Point: 211.2°C at 760 mmHg
  • Flash Point: 79.5°C
  • Refractive Index: 1.491
  • PSA: 26.3

methyl 3-fluoro-2-methylbenzoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
M706725-10mg
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 $ 50.00 2022-06-03
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methyl 3-fluoro-2-methylbenzoate
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