Cas no 1096879-46-7 (3-Amino-4-(isopentyloxy)benzoic Acid)

3-Amino-4-(isopentyloxy)benzoic Acid structure
1096879-46-7 structure
Product Name:3-Amino-4-(isopentyloxy)benzoic Acid
CAS No:1096879-46-7
MF:C12H17NO3
MW:223.268283605576
MDL:MFCD12168704
CID:1188789
PubChem ID:43379737
Update Time:2025-04-20

3-Amino-4-(isopentyloxy)benzoic Acid Chemical and Physical Properties

Names and Identifiers

    • 3-amino-4-isopentyloxy-benzoic Acid
    • 3-Amino-4-(isopentyloxy)benzoicacid
    • AKOS009475172
    • SB77062
    • WTB87946
    • MFCD12168704
    • 3-Amino-4-(3-methylbutoxy)benzoic acid
    • 1096879-46-7
    • 3-Amino-4-(isopentyloxy)benzoic acid
    • PS-5025
    • 3-Amino-4-(isopentyloxy)benzoic Acid
    • MDL: MFCD12168704
    • Inchi: 1S/C12H17NO3/c1-8(2)5-6-16-11-4-3-9(12(14)15)7-10(11)13/h3-4,7-8H,5-6,13H2,1-2H3,(H,14,15)
    • InChI Key: WCRXLOVISGRZSQ-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C(=O)O)=CC=1N)CCC(C)C

Computed Properties

  • Exact Mass: 223.12084340g/mol
  • Monoisotopic Mass: 223.12084340g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 230
  • 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: 2.3
  • Topological Polar Surface Area: 72.6?2

3-Amino-4-(isopentyloxy)benzoic Acid Pricemore >>

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abcr
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3-Amino-4-(isopentyloxy)benzoic acid, min. 95%; .
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