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1-(tetrazol-1-yl)ethanone

1-(tetrazol-1-yl)ethanone structure

CAS No:
21565-41-3
Formula:
C3H4N4O
Chemical Name:
1-(tetrazol-1-yl)ethanone
Synonyms:
N-acetyl-1-tetrazole-1,2,3,4; 1-acetyl-tetrazole; 1-Acetyl-1H-tetrazole; 1-Acetyl-tetrazol-1,2,3,4; N-Acetyl-tetrazol;

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1-(tetrazol-1-yl)ethanone Basic Attributes

Molecular Weight：

112.09000

Exact Mass：

112.03851076 g/mol

DSSTox ID：

DTXSID10175910

HScode：

2933990090

Characteristics

PSA：

60.67000

XLogP3：

-0.66680

Density：

1.52g/cm3

Boiling Point：

238.9ºC

Flash Point：

98.3ºC

Refractive Index：

1.676

Vapor Pressure：

0.0413mmHg at 25°C

Computed Properties

Molecular Weight:112.09
XLogP3:-0.6
Hydrogen Bond Acceptor Count:4
Exact Mass:112.03851076
Monoisotopic Mass:112.03851076
Topological Polar Surface Area:60.7
Heavy Atom Count:8
Complexity:104
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(tetrazol-1-yl)ethanone

Basic Attributes
Characteristics
Computed Properties

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