Cas no 409346-68-5 (4-Isopropoxycyclohexanecarboxylic acid)

4-Isopropoxycyclohexanecarboxylic acid structure
409346-68-5 structure
Product Name:4-Isopropoxycyclohexanecarboxylic acid
CAS No:409346-68-5
MF:C10H18O3
MW:186.248123645782
CID:2950760
PubChem ID:21061128
Update Time:2025-04-21

4-Isopropoxycyclohexanecarboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-異丙氧基環(huán)己酸
    • 4-(1-Methylethoxy)-cyclohexanecarboxylic acid
    • 4-Isopropoxycyclohexanecarboxylic acid
    • 4-(1-Methylethoxy)cyclohexanecarboxylic acid
    • 4-propan-2-yloxycyclohexane-1-carboxylic acid
    • cis-4-isopropoxycyclohexanecarboxylic acid
    • trans-4-isopropoxycyclohexanecarboxylic acid
    • Cyclohexanecarboxylic acid, 4-(1-methylethoxy)-
    • ZB1706
    • C78210
    • Rel-(1r,4r)-4-isopropoxycyclohexane-1-carboxylic acid
    • Rel-(1s,4s)-4-isoprop
    • Rel-(1s,4s)-4-isopropoxycyclohexane-1-carboxylic acid
    • SCHEMBL8175511
    • SB75285
    • SCHEMBL17803070
    • 2134663-33-3
    • 409346-68-5
    • 4-(propan-2-yloxy)cyclohexane-1-carboxylic acid
    • 1940134-52-0
    • SCHEMBL25477011
    • SB75284
    • DB-152330
    • SCHEMBL22184758
    • Inchi: 1S/C10H18O3/c1-7(2)13-9-5-3-8(4-6-9)10(11)12/h7-9H,3-6H2,1-2H3,(H,11,12)
    • InChI Key: QNCAUDDXPCGFLZ-UHFFFAOYSA-N
    • SMILES: O(C(C)C)C1CCC(C(=O)O)CC1

Computed Properties

  • Exact Mass: 186.125594432Da
  • Monoisotopic Mass: 186.125594432Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 169
  • 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: 1.7
  • Topological Polar Surface Area: 46.5

4-Isopropoxycyclohexanecarboxylic acid Pricemore >>

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