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1-PYRIDIN-2-YL-1H-PYRAZOLE-4-CARBOXYLICACID

1-PYRIDIN-2-YL-1H-PYRAZOLE-4-CARBOXYLICACID structure

CAS No:
77556-50-4
Formula:
C9H7N3O2
Chemical Name:
1-PYRIDIN-2-YL-1H-PYRAZOLE-4-CARBOXYLICACID
Synonyms:
2-(pyrazol-1'-yl)pyridine-4'-carboxylic acid;1-PYRIDIN-2-YL-1H-PYRAZOLE-4-CARBOXYLIC ACID;1-(2-PYRIDINYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID;OTAVA-BB 1182244;1H-Pyrazole-4-carboxylic acid, 1-(2-pyridinyl)-

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1-PYRIDIN-2-YL-1H-PYRAZOLE-4-CARBOXYLICACID Basic Attributes

Molecular Weight：

189.17

Exact Mass：

189.053826475

HScode：

2933990090

Characteristics

PSA：

68.01000

XLogP3：

0.96550

Density：

1.39±0.1 g/cm3

Melting Point：

182-183 °C(Solv: methanol (67-56-1))

Boiling Point：

415.9±20.0 °C(Predicted)

PKA：

3.48±0.10

Safety Information

hazard class code：

safety instructions：

Marks：

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:189.17
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:189.053826475
Monoisotopic Mass:189.053826475
Topological Polar Surface Area:68
Heavy Atom Count:14
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-PYRIDIN-2-YL-1H-PYRAZOLE-4-CARBOXYLICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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