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34376-54-0

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34376-54-0 Structure

34376-54-0 Structure
IdentificationMore
[Name]

2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one
[CAS]

34376-54-0
[Synonyms]

[1,4]DIAZEPAN-5-ONE
1,4-DIAZEPAN-5-ONE ACETATE
2,3,6,7-TETRAHYDRO-(1H)-1,4-DIAZEPIN-5-(4H)-ONE
5-HOMOPIPERAZINONE
Homopiperazin-5-one
5H-1,4-DIAZEPIN-5-ONE, HEXAHYDRO-
[Molecular Formula]

C5H10N2O
[MDL Number]

MFCD00766804
[Molecular Weight]

114.15
[MOL File]

34376-54-0.mol
Chemical PropertiesBack Directory
[Melting point ]

65-68
[Boiling point ]

308.8±35.0 °C(Predicted)
[density ]

1.012±0.06 g/cm3(Predicted)
[form ]

solid
[pka]

16.21±0.20(Predicted)
[color ]

White to off-white
[InChI]

InChI=1S/C5H10N2O/c8-5-1-2-6-3-4-7-5/h6H,1-4H2,(H,7,8)
[InChIKey]

QPPLBCQXWDBQFS-UHFFFAOYSA-N
[SMILES]

N1CCC(=O)NCC1
[CAS DataBase Reference]

34376-54-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36
[Safety Statements ]

26
[Hazard Note ]

Irritant
[HazardClass ]

HYGROSCOPIC
[HS Code ]

2933998090
Hazard InformationBack Directory
[Synthesis Reference(s)]

Journal of the American Chemical Society, 106, p. 630, 1984 DOI: 10.1021/ja00315a030
Spectrum DetailBack Directory
[Spectrum Detail]

2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one(34376-54-0)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Homopiperazin-5-one, 95%(34376-54-0)
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