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2-(3-Pyridinyl)-1H-imidazole-5-carboxaldehyde

2-(3-Pyridinyl)-1H-imidazole-5-carboxaldehyde structure

CAS No:
279251-09-1
Formula:
C9H7N3O
Chemical Name:
2-(3-Pyridinyl)-1H-imidazole-5-carboxaldehyde
Synonyms:
1H-Imidazole-5-carboxaldehyde,2-(3-pyridinyl)-;1H-Imidazole-4-carboxaldehyde,2-(3-pyridinyl)-;2-(3-Pyridinyl)-1H-imidazole-5-carboxaldehyde;2-(Pyridin-3-yl)-1H-imidazole-5-carbaldehyde;2-(Pyridin-3-yl)-1H-imidazole-4-carbaldehyde

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2-(3-Pyridinyl)-1H-imidazole-5-carboxaldehyde Basic Attributes

Molecular Weight：

173.17

Exact Mass：

173.17

DSSTox ID：

DTXSID30442676

Characteristics

PSA：

58.64000

XLogP3：

1.28420

Density：

1.320±0.06 g/cm3

Melting Point：

175 °C

Boiling Point：

464.3±25.0 °C(Predicted)

PKA：

9.98±0.10

Computed Properties

Molecular Weight:173.17
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:173.058911855
Monoisotopic Mass:173.058911855
Topological Polar Surface Area:58.6
Heavy Atom Count:13
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(3-Pyridinyl)-1H-imidazole-5-carboxaldehyde

Basic Attributes
Characteristics
Computed Properties

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