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2-(Hexahydro-1H-1,4-diazepin-1-yl)-3-pyridinecarbonitrile

2-(Hexahydro-1H-1,4-diazepin-1-yl)-3-pyridinecarbonitrile structure

CAS No:
352018-97-4
Formula:
C11H14N4
Chemical Name:
2-(Hexahydro-1H-1,4-diazepin-1-yl)-3-pyridinecarbonitrile
Synonyms:
3-Pyridinecarbonitrile,2-(hexahydro-1H-1,4-diazepin-1-yl)-;2-(Hexahydro-1H-1,4-diazepin-1-yl)-3-pyridinecarbonitrile;2-(1,4-Diazepan-1-yl)nicotinonitrile;2-([1,4]Diazepan-1-yl)pyridine-3-carbonitrile

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2-(Hexahydro-1H-1,4-diazepin-1-yl)-3-pyridinecarbonitrile Basic Attributes

Molecular Weight：

202.26

Exact Mass：

202.26

DSSTox ID：

DTXSID50381492

HScode：

2933990090

Characteristics

PSA：

XLogP3：

1.14678

Density：

1.18g/cm3

Boiling Point：

394ºC at 760 mmHg

Flash Point：

192.1ºC

Refractive Index：

1.592

Safety Information

Transport codes：

3276

hazard class code：

20/21/22-25

safety instructions：

26-36/37/39-45

Marks：

Computed Properties

Molecular Weight:202.26
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:202.121846464
Monoisotopic Mass:202.121846464
Topological Polar Surface Area:52
Heavy Atom Count:15
Complexity:244
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(Hexahydro-1H-1,4-diazepin-1-yl)-3-pyridinecarbonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-(Hexahydro-1H-1,4-diazepin-1-yl)-3-pyridinecarbonitrile

SDS

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