Cas no 610791-39-4 (1-(pyridin-3-yl)cyclopropane-1-carboxylic acid)

1-(pyridin-3-yl)cyclopropane-1-carboxylic acid structure
610791-39-4 structure
Product Name:1-(pyridin-3-yl)cyclopropane-1-carboxylic acid
CAS No:610791-39-4
MF:C9H9NO2
MW:163.173262357712
MDL:MFCD13188647
CID:829682
Update Time:2024-11-04

1-(pyridin-3-yl)cyclopropane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 1-(3-pyridinyl)-Cyclopropanecarboxylic acid
    • 1-(Pyridin-3-yl)cyclopropanecarboxylic acid
    • 1-(3-Pyridyl)cyclopropanecarboxylic Acid
    • 1-pyridin-3-ylcyclopropane-1-carboxylic acid
    • AB66842
    • AK-47242
    • ANW-70574
    • CTK8C3812
    • KB-09634
    • MolPort-022-151-945
    • SureCN4825571
    • CYCLOPROPANECARBOXYLIC ACID, 1-(3-PYRIDINYL)-
    • 1-(PYRIDIN-3-YL)CYCLOPROPANE-1-CARBOXYLIC ACID
    • HYEMICHUSHXQTM-UHFFFAOYSA-N
    • 9140AB
    • CM10540
    • ST24021189
    • 1-(pyridin-3-yl)cyclopropane-1-carboxylic acid
    • MDL: MFCD13188647
    • Inchi: 1S/C9H9NO2/c11-8(12)9(3-4-9)7-2-1-5-10-6-7/h1-2,5-6H,3-4H2,(H,11,12)
    • InChI Key: HYEMICHUSHXQTM-UHFFFAOYSA-N
    • SMILES: OC(C1(C2C=NC=CC=2)CC1)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 199
  • Topological Polar Surface Area: 50.2

Experimental Properties

  • Density: 1.344±0.06 g/cm3 (20 oC 760 Torr),
  • Solubility: Slightly soluble (23 g/l) (25 o C),

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