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1-(5-methyl-1{H}-tetrazol-1-yl)acetone

1-(5-methyl-1{H}-tetrazol-1-yl)acetone structure

CAS No:
83485-70-5
Formula:
C5H8N4O
Chemical Name:
1-(5-methyl-1{H}-tetrazol-1-yl)acetone
Synonyms:
1-(5-methyl-1{H}-tetrazol-1-yl)acetone;2-Propanone, 1-(5-methyl-1H-tetrazol-1-yl)-

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1-(5-methyl-1{H}-tetrazol-1-yl)acetone Basic Attributes

Molecular Weight：

140.14

Exact Mass：

140.06981089 g/mol

Characteristics

PSA：

60.7 Å²

Density：

1.33±0.1 g/cm3

Melting Point：

98.5-99.5 °C(Solv: benzene (71-43-2))

Boiling Point：

336.0±21.0 °C(Predicted)

PKA：

0.61±0.10

Computed Properties

Molecular Weight:140.14
XLogP3:-0.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:140.06981089
Monoisotopic Mass:140.06981089
Topological Polar Surface Area:60.7
Heavy Atom Count:10
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(5-methyl-1{H}-tetrazol-1-yl)acetone

Basic Attributes
Characteristics
Computed Properties

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