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1,4-Diazabicyclo[2.2.2]octan-2-one(9CI)

1,4-Diazabicyclo[2.2.2]octan-2-one(9CI) structure

CAS No:
146562-83-6
Formula:
C6H10N2O
Chemical Name:
1,4-Diazabicyclo[2.2.2]octan-2-one(9CI)
Synonyms:
1,4-Diazabicyclo[2.2.2]octan-2-one(9CI);1,4-Diazabicyclo[2.2.2]octan-2-one

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1,4-Diazabicyclo[2.2.2]octan-2-one(9CI) Basic Attributes

Molecular Weight：

126.159

Exact Mass：

126.07900

DSSTox ID：

DTXSID20627718

Characteristics

PSA：

23.55000

XLogP3：

-0.7

Density：

1.25±0.1 g/cm3(Predicted)

Boiling Point：

247.7±39.0 °C(Predicted)

Computed Properties

Molecular Weight:126.16
XLogP3:-0.7
Hydrogen Bond Acceptor Count:2
Exact Mass:126.079312947
Monoisotopic Mass:126.079312947
Topological Polar Surface Area:23.6
Heavy Atom Count:9
Complexity:138
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,4-Diazabicyclo[2.2.2]octan-2-one(9CI)

Basic Attributes
Characteristics
Computed Properties

1,4-Diazabicyclo[2.2.2]octan-2-one(9CI)

SDS

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