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2,6-bis(hydroxyMethyl)isonicotinonitrile

2,6-bis(hydroxyMethyl)isonicotinonitrile structure

CAS No:
148258-04-2
Formula:
C8H8N2O2
Chemical Name:
2,6-bis(hydroxyMethyl)isonicotinonitrile
Synonyms:
2,6-bis(hydroxymethyl)isonicotinonitrile;148258-04-2;SCHEMBL9564934;AKOS025396587;2,6-bis(hydroxymethyl)pyridine-4-carbonitrile;4-Pyridinecarbonitrile, 2,6-bis(hydroxymethyl)-

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2,6-bis(hydroxyMethyl)isonicotinonitrile Basic Attributes

Molecular Weight：

164.16132

Exact Mass：

164.059

Characteristics

PSA：

77.1

XLogP3：

-1.1

Density：

1.36±0.1 g/cm3(Predicted)

Boiling Point：

354.9±37.0 °C(Predicted)

Computed Properties

Molecular Weight:164.16
XLogP3:-1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:164.058577502
Monoisotopic Mass:164.058577502
Topological Polar Surface Area:77.1
Heavy Atom Count:12
Complexity:175
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,6-bis(hydroxyMethyl)isonicotinonitrile

Basic Attributes
Characteristics
Computed Properties

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