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1-[(2-Chlorophenyl)methyl]-3-isothiocyanato-1H-pyrazole

1-[(2-Chlorophenyl)methyl]-3-isothiocyanato-1H-pyrazole structure

CAS No:
1004194-44-8
Formula:
C11H8ClN3S
Chemical Name:
1-[(2-Chlorophenyl)methyl]-3-isothiocyanato-1H-pyrazole
Synonyms:
1H-Pyrazole,1-[(2-chlorophenyl)methyl]-3-isothiocyanato-;1-[(2-Chlorophenyl)methyl]-3-isothiocyanato-1H-pyrazole

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1-[(2-Chlorophenyl)methyl]-3-isothiocyanato-1H-pyrazole Basic Attributes

Molecular Weight：

249.72

Exact Mass：

249.72

Characteristics

PSA：

62.3

XLogP3：

4.2

Computed Properties

Molecular Weight:249.72
XLogP3:4.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:249.0127461
Monoisotopic Mass:249.0127461
Topological Polar Surface Area:62.3
Heavy Atom Count:16
Complexity:280
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[(2-Chlorophenyl)methyl]-3-isothiocyanato-1H-pyrazole

Basic Attributes
Characteristics
Computed Properties

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