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Ethyl5-amino-4-cyano-1-(4-iodophenyl)pyrazole-3-carboxylate

Ethyl5-amino-4-cyano-1-(4-iodophenyl)pyrazole-3-carboxylate structure

CAS No:
1150164-64-9
Formula:
C13H11IN4O2
Chemical Name:
Ethyl5-amino-4-cyano-1-(4-iodophenyl)pyrazole-3-carboxylate
Synonyms:
ETHYL 5-AMINO-4-CYANO-1-(4-IODOPHENYL)PYRAZOLE-3-CARBOXYLATE;CTK4A9096;DTXSID90674951;ANW-16808;MFCD09835743;ZINC38537378;AKOS015854725;K-1076;Ethyl 5-amino-4-cyano-1-(4-iodophenyl)-1H-pyrazole-3-carboxylate

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Ethyl5-amino-4-cyano-1-(4-iodophenyl)pyrazole-3-carboxylate Basic Attributes

Molecular Weight：

382.15651

Exact Mass：

381.99300

DSSTox ID：

DTXSID90674951

Characteristics

PSA：

93.93000

XLogP3：

2.68868

Density：

1.78±0.1 g/cm3(Predicted)

Boiling Point：

548.4±50.0 °C(Predicted)

Computed Properties

Molecular Weight:382.16
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:381.99267
Monoisotopic Mass:381.99267
Topological Polar Surface Area:93.9
Heavy Atom Count:20
Complexity:402
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl5-amino-4-cyano-1-(4-iodophenyl)pyrazole-3-carboxylate

Basic Attributes
Characteristics
Computed Properties

Ethyl5-amino-4-cyano-1-(4-iodophenyl)pyrazole-3-carboxylate

SDS

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