Pyrazine-2-carboximidamide

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Basic information

CAS: 200928-43-4
Standard SMILES: N=C(N)c1cnccn1
InChIKey: CEEVRMDYKKNRAW-UHFFFAOYSA-N
Molecular formula: C5H6N4
Average molar mass: 122.13 g/mol
Monoisotopic mass: 122.05924621

Names & identifiers

Preferred name: Pyrazine-2-carboximidamide
IUPAC: pyrazine-2-carboximidamide
English name: Pyrazine-2-carboxamidine
Molecular formula: C5H6N4
Molecular weight: 122.13

Names & synonyms

Pyrazine-2-carboximidamide200928-43-4DTXSID60332879RefChem:375932DTXCID30200415Pyrazine-2-carboxamidinePyrazinecarboximidamideSCHEMBL1442775SCHEMBL6279386CEEVRMDYKKNRAW-UHFFFAOYSA-NALBB-006156BBL004495

Show more names

2-Pyrazinecarboximidamide

STK503742AKOS005171618BS-3753AC-26731DA-19442CS-0271088EN300-1261574

Database identifiers

CAS: 200928-43-4
PubChem CID: 470896
DTXSID: DTXSID60332879
Nikkaji: J2.197.974K

Properties

Computed structural properties

XLogP: -0.5
Topological polar surface area: 75.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 9
Formal charge: 0
Complexity: 112

Physicochemical properties

Boiling point: 253.5 · 253.5±43.0 °C(Predicted)
Density: 1.39 · 1.39±0.1 g/cm3(Predicted)
pka: 9.08 · 9.08±0.50(Predicted)

Related reactions

3 records

New reaction record

HRID 666470As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 1148377As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1218812As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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