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Home > Encyclopedia > 4-(1H-imidazol-5-yl)benzoic acid

4-(1H-imidazol-5-yl)benzoic acid

4-(1H-imidazol-5-yl)benzoic acid structure

4-(1H-imidazol-5-yl)benzoic acid 

structure
  • CAS No:

    13569-97-6

  • Formula:

    C10H8N2O2

  • Chemical Name:

    4-(1H-imidazol-5-yl)benzoic acid

  • Synonyms:

    4-imidazol-4-ylbenzoic acid;

  • Categories:

    Organic Chemistry  >  Nitrogen Compounds

4-(1H-imidazol-5-yl)benzoic acid Basic Attributes

188.18300

188.058577502

DTXSID60595169

2933290090

Characteristics

65.98000

1.77490

1.355g/cm3

512.1ºC at 760mmHg

263.5ºC

1.644

2.6E-11mmHg at 25°C

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:188.18
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:188.058577502
Monoisotopic Mass:188.058577502
Topological Polar Surface Area:66
Heavy Atom Count:14
Complexity:212
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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