Cas no 4385-78-8 (3,4-PBC)

3,4-PBC structure
3,4-PBC structure
Product Name:3,4-PBC
CAS No:4385-78-8
MF:C12H9NO2
MW:199.205363035202
MDL:MFCD05864808
CID:333609
PubChem ID:2795562
Update Time:2025-04-19

3,4-PBC Chemical and Physical Properties

Names and Identifiers

    • 3-(Pyridin-4-yl)benzoic acid
    • 3-Pyrid-4-ylbenzoic acid
    • 3-pyridin-4-ylbenzoic acid
    • 3-PYRIDIN-4-YL-BENZOIC ACID
    • Benzoic acid,3-(4-pyridinyl)-
    • 3-(4-pyridyl)benzoic acid
    • 3-(4-pyridinyl)benzoic acid
    • 4-(3-Carboxyphenyl)pyridine
    • 3-(Pyridin-4-yl)benzoic aci
    • IYGIZNZSONLPSI-UHFFFAOYSA-N
    • SBB052681
    • BDBM50195794
    • 3-pyrid-4-ylbenzoic acid, AldrichCPR
    • RP04206
    • C
    • ST241
    • 3,4-PBC
    • MDL： MFCD05864808
    • Inchi： 1S/C12H9NO2/c14-12(15)11-3-1-2-10(8-11)9-4-6-13-7-5-9/h1-8H,(H,14,15)
    • InChI Key： IYGIZNZSONLPSI-UHFFFAOYSA-N
    • SMILES： OC(C1=CC=CC(=C1)C1C=CN=CC=1)=O

Computed Properties

  • Exact Mass: 199.06300
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 224
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.6
  • Topological Polar Surface Area: 50.2

Experimental Properties

  • Color/Form: Uncertain
  • Density: 1.241±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 268 °C
  • Boiling Point: 405°C at 760 mmHg
  • Solubility: Slightly soluble (1.9 g/l) (25 o C),
  • PSA: 50.19000
  • LogP: 2.44680
  • Solubility: Uncertain

3,4-PBC Security Information

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3,4-PBC Production Method

3,4-PBC Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:4385-78-8)3,4-PBC
Order Number:A854932
Stock Status:in Stock
Quantity:10g/25g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 07:53
Price ($):202.0/369.0

3,4-PBC Related Literature

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Recommended suppliers
Amadis Chemical Company Limited
(CAS:4385-78-8)3,4-PBC
A854932
Purity:99%/99%
Quantity:10g/25g
Price ($):202.0/369.0
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