Cas no 1186663-49-9 (2-Methyl-3-(methylsulfonyl)benzoic acid)

2-Methyl-3-(methylsulfonyl)benzoic acid structure
1186663-49-9 structure
Product Name:2-Methyl-3-(methylsulfonyl)benzoic acid
CAS No:1186663-49-9
MF:C9H10O4S
MW:214.238301753998
MDL:MFCD12828710
CID:1056186
PubChem ID:53429579
Update Time:2025-04-20

2-Methyl-3-(methylsulfonyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Methyl-3-(methylsulfonyl)benzoic acid
    • 1,1-Diphenyl-2-methyl-3-(N-methyl-N-phenethylamino)-1-propanol
    • 1-Propanol,1,1-diphenyl-2-methyl-3-methylphenethylamino
    • 2-Methyl-3-(methyl-phenaethyl-amino)-1,1-diphenyl-propan-1-ol
    • 2-Methyl-3-(methylsulfonyl)benzoicAcid
    • WMALKKDIJHZYRM-UHFFFAOYSA-N
    • 3-Methanesulfonylmethylbenzoic acid
    • 5582AJ
    • 2-methyl-3-methylsulfonylbenzoic acid
    • 3-methanesulfonyl-2-methylbenzoic acid
    • TRA0094561
    • SY006348
    • AB0065562
    • 1186663-49-9
    • AS-31979
    • AMY20199
    • AKOS015852474
    • MFCD12828710
    • DTXSID901279906
    • DB-014547
    • SCHEMBL147992
    • MDL: MFCD12828710
    • Inchi: 1S/C9H10O4S/c1-6-7(9(10)11)4-3-5-8(6)14(2,12)13/h3-5H,1-2H3,(H,10,11)
    • InChI Key: WMALKKDIJHZYRM-UHFFFAOYSA-N
    • SMILES: S(C)(C1C=CC=C(C(=O)O)C=1C)(=O)=O

Computed Properties

  • Exact Mass: 214.03000
  • Monoisotopic Mass: 214.02997997g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 314
  • 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
  • Topological Polar Surface Area: 79.8
  • XLogP3: 1.1

Experimental Properties

  • PSA: 79.82000
  • LogP: 2.17750

2-Methyl-3-(methylsulfonyl)benzoic acid Customs Data

  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

2-Methyl-3-(methylsulfonyl)benzoic acid Pricemore >>

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