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1,3-Dimethyl-1H-pyrazole-5-carbothioamide

1,3-Dimethyl-1H-pyrazole-5-carbothioamide structure

CAS No:
844891-03-8
Formula:
C6H9N3S
Chemical Name:
1,3-Dimethyl-1H-pyrazole-5-carbothioamide
Synonyms:
1H-Pyrazole-5-carbothioamide,1,3-dimethyl-;1,3-Dimethyl-1H-pyrazole-5-carbothioamide

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1,3-Dimethyl-1H-pyrazole-5-carbothioamide Basic Attributes

Molecular Weight：

155.22100

Exact Mass：

155.22

DSSTox ID：

DTXSID60383609

HScode：

2933199090

Characteristics

PSA：

75.93000

XLogP3：

1.06300

Density：

1.29g/cm3

Melting Point：

170ºC

Boiling Point：

304.8ºC

Flash Point：

138.1ºC

Refractive Index：

1.647

Computed Properties

Molecular Weight:155.22
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:155.05171847
Monoisotopic Mass:155.05171847
Topological Polar Surface Area:75.9
Heavy Atom Count:10
Complexity:148
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-Dimethyl-1H-pyrazole-5-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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