Hexahydro-1H-pyrido[1,2-A]pyrazin-3(2H)-one
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Basic information
- CAS
15932-74-8- Standard SMILES
O=C1CN2CCCCC2CN1- InChIKey
CSBUPKXPDSKABE-UHFFFAOYSA-N- Molecular formula
- C8H14N2O
- Average molar mass
- 154.21 g/mol
- Monoisotopic mass
- 154.11061307
Names & identifiers
- Preferred name
- Hexahydro-1H-pyrido[1,2-A]pyrazin-3(2H)-one
- IUPAC
- 1,2,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-3-one
- English name
- 2H-Pyrido[1,2-a]pyrazin-3(4H)-one,hexahydro-(8CI)
- Molecular formula
- C8H14N2O
- Molecular weight
- 154.21
Names & synonyms
15932-74-8HEXAHYDRO-1H-PYRIDO[1,2-A]PYRAZIN-3(2H)-ONEhexahydro-2h-pyrido[1,2-a]pyrazin-3(4h)-one1,2,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-3-oneHexahydro-2H-pyrido(1,2-a)pyrazin-3(4H)-oneNSC135472DTXSID20300236CSBUPKXPDSKABE-UHFFFAOYSA-NAKOS024259440NSC-135472SB461532H-Pyrido[1,2-a]pyrazin-3(4H)-one,hexahydro-(8CI)
Show more names
2H-Pyrido[1,2-a]pyrazin-3(4H)-one, hexahydro-
Database identifiers
- CAS
15932-74-8- PubChem CID
- 282263
- DTXSID
DTXSID20300236- Nikkaji
- J1.424.625H
Properties
Computed structural propertiesFilling in
- XLogP
- 0.3
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Melting point
- 114 · 114-115 °C(Solv: ethyl acetate (141-78-6))
- Boiling point
- 329.5 · 329.5±35.0 °C(Predicted)
- Density
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 15.23 · 15.23±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Compound notes
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