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4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzonitrile

4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzonitrile structure

CAS No:
882230-46-8
Formula:
C13H12N4O2
Chemical Name:
4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzonitrile
Synonyms:
SCHEMBL16832771;4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzonitrile;ZINC3322005;AKOS005943124;MCULE-1377065424;SR-01000044239;SR-01000044239-1;Z25768030;4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzonitrile;882230-46-8

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4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzonitrile Basic Attributes

Molecular Weight：

256.26 g/mol

Exact Mass：

256.09602564 g/mol

Characteristics

PSA：

87.4 Å²

Computed Properties

Molecular Weight:256.26
XLogP3:2.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:256.09602564
Monoisotopic Mass:256.09602564
Topological Polar Surface Area:87.4
Heavy Atom Count:19
Complexity:378
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzonitrile

Basic Attributes
Characteristics
Computed Properties

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