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2-oxopiperidine-3-carbonitrile

2-oxopiperidine-3-carbonitrile structure

CAS No:
89532-42-3
Formula:
C6H8N2O
Chemical Name:
2-oxopiperidine-3-carbonitrile
Synonyms:
2-oxopiperidine-3-carbonitrile;3-Piperidinecarbonitrile, 2-oxo-

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2-oxopiperidine-3-carbonitrile Basic Attributes

Molecular Weight：

124.14

Exact Mass：

124.063662883

DSSTox ID：

DTXSID30598001

Characteristics

Density：

1.14±0.1 g/cm3

Melting Point：

68-70 °C

Boiling Point：

395.1±35.0 °C(Predicted)

PKA：

18.96±0.40

Computed Properties

Molecular Weight:124.14
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:124.063662883
Monoisotopic Mass:124.063662883
Topological Polar Surface Area:52.9
Heavy Atom Count:9
Complexity:167
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-oxopiperidine-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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