2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one Structure

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

Chemical Properties

Melting point 65-68
Boiling point 308.8±35.0 °C(Predicted)
Density  1.012±0.06 g/cm3(Predicted)
storage temp.  Storage temp. 2-8°C
pka 16.21±0.20(Predicted)
form  solid
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

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi
Risk Statements  36
Safety Statements  26
Hazard Note  Irritant
HazardClass  HYGROSCOPIC
HS Code  2933998090
NFPA 704:
1
2 0

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