Cas no 1131615-01-4 (3-Bromo-4-propylbenzoic acid)

3-Bromo-4-propylbenzoic acid structure
3-Bromo-4-propylbenzoic acid structure
Product Name:3-Bromo-4-propylbenzoic acid
CAS No:1131615-01-4
MF:C10H11BrO2
MW:243.097142457962
MDL:MFCD11110861
CID:1035040
PubChem ID:20387043
Update Time:2025-04-20

3-Bromo-4-propylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-4-propylbenzoic acid
    • 3-bromanyl-4-propyl-benzoic acid
    • AK130409
    • CTK8E2193
    • FT-0652780
    • KB-145070
    • SBB067756
    • E76178
    • VLXUNAMNAIRVJU-UHFFFAOYSA-N
    • DB-060460
    • 3-Bromo-4-propylbenzoicacid
    • 4-propyl-3-bromo-benzoic acid
    • DTXSID80606544
    • 1131615-01-4
    • SCHEMBL11509525
    • A802943
    • AKOS015843304
    • BS-49793
    • CS-0188020
    • MDL: MFCD11110861
    • Inchi: 1S/C10H11BrO2/c1-2-3-7-4-5-8(10(12)13)6-9(7)11/h4-6H,2-3H2,1H3,(H,12,13)
    • InChI Key: VLXUNAMNAIRVJU-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C(=O)O)C=CC=1CCC

Computed Properties

  • Exact Mass: 241.99424g/mol
  • Monoisotopic Mass: 241.99424g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 182
  • 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: 3.5
  • Topological Polar Surface Area: 37.3?2

3-Bromo-4-propylbenzoic acid Pricemore >>

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