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tert-Butylpyrazine

tert-Butylpyrazine structure

CAS No:
32741-11-0
Formula:
C8H12N2
Chemical Name:
tert-Butylpyrazine
Synonyms:
Pyrazine,2-(1,1-dimethylethyl)-;Pyrazine,(1,1-dimethylethyl)-;Pyrazine,tert-butyl-;2-(1,1-Dimethylethyl)pyrazine;tert-Butylpyrazine;2-tert-Butylpyrazine
Categories:
Chemical Reagents > Organic Reagents

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tert-Butylpyrazine Basic Attributes

Molecular Weight：

136.19

Exact Mass：

136.19

EC Number：

251-186-7

UNII：

5278IBF644

DSSTox ID：

DTXSID3047421

HScode：

2933990090

Characteristics

PSA：

25.78000

XLogP3：

1.77410

Density：

0.955±0.06 g/cm3

Boiling Point：

179.9±20.0 °C(Predicted)

Flash Point：

66.6ºC

Refractive Index：

1.4870-1.4910

PKA：

1.79±0.10

Safety Information

hazard class code：

36/37/38-36

safety instructions：

26-36/37/39

GHS Classification：

|Warning|H226 (94.62%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 93 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

tert-Butylpyrazine Use and Manufacturing

Manufacturing Info：

Pyrazine, 2-(1,1-dimethylethyl)-: ACTIVE

Computed Properties

Molecular Weight:136.19
XLogP3:1.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:136.100048391
Monoisotopic Mass:136.100048391
Topological Polar Surface Area:25.8
Heavy Atom Count:10
Complexity:104
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes