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1H-1,2,3-Triazole-5-carbothioamide

1H-1,2,3-Triazole-5-carbothioamide structure

CAS No:
885280-96-6
Formula:
C3H4N4S
Chemical Name:
1H-1,2,3-Triazole-5-carbothioamide
Synonyms:
1H-1,2,3-Triazole-5-carbothioamide;1H-1,2,3-Triazole-4-carbothioamide

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1H-1,2,3-Triazole-5-carbothioamide Basic Attributes

Molecular Weight：

128.15600

Exact Mass：

128.16

DSSTox ID：

DTXSID90672937

HScode：

2933990090

Characteristics

PSA：

99.68000

XLogP3：

0.13920

Density：

1.586g/cm3

Boiling Point：

379.2ºC

Flash Point：

183.1ºC

Refractive Index：

1.754

Computed Properties

Molecular Weight:128.16
XLogP3:-0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:128.01566732
Monoisotopic Mass:128.01566732
Topological Polar Surface Area:99.7
Heavy Atom Count:8
Complexity:104
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1H-1,2,3-Triazole-5-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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