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1-acetyl-1{H}-1,2,4-triazole-3,5-diamine

1-acetyl-1{H}-1,2,4-triazole-3,5-diamine structure

CAS No:
86147-15-1
Formula:
C4H7N5O
Chemical Name:
1-acetyl-1{H}-1,2,4-triazole-3,5-diamine
Synonyms:
1-acetyl-1{H}-1,2,4-triazole-3,5-diamine;Ethanone, 1-(3,5-diamino-1H-1,2,4-triazol-1-yl)-

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1-acetyl-1{H}-1,2,4-triazole-3,5-diamine Basic Attributes

Molecular Weight：

141.13

Exact Mass：

141.06505986

DSSTox ID：

DTXSID90389619

Characteristics

Density：

1.79±0.1 g/cm3

Melting Point：

198-200 °C

Boiling Point：

433.8±28.0 °C(Predicted)

PKA：

3.26±0.50

Computed Properties

Molecular Weight:141.13
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Exact Mass:141.06505986
Monoisotopic Mass:141.06505986
Topological Polar Surface Area:99.8
Heavy Atom Count:10
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-acetyl-1{H}-1,2,4-triazole-3,5-diamine

Basic Attributes
Characteristics
Computed Properties

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