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 Information

Hazard Codes 

Xi

Risk Statements 

36

Safety Statements 

26

Hazard Note 

Irritant

HazardClass 

HYGROSCOPIC

HS Code 

2933998090

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

Synthesis Reference(s)

Journal of the American Chemical Society, 106, p. 630, 1984 DOI: 10.1021/ja00315a030

2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one(34376-54-0)Related Product Information

• 2,3,6,7-Tetrahydro-(1H)-1,4-diazepin-5(4H)-one
• 1-Benzyl-1,4-diazepan-5-one
• 1-Cbz-[1,4]diazepan-5-one
• 1-N-Boc-5-oxo-1,4-diazepane
• 1-(PIPERIDIN-4-YL)-1,4-DIAZEPAN-5-ONE
• 1,4-Diazepan-5-one hydrochloride,1,4-diazepan-5-one(HCl)
• 1-ETHYL-[1,4]DIAZEPAN-5-ONE
• 1-benzyl-1,4-diazepan-5-one(HCl)
• CYCLOHEPTANE
• Homopiperazine
• Cycloheptanone
• 4-OXO-4-(5-OXO-1,4-DIAZEPAN-1-YL)BUTANOICACID
• 4-[2-(DIMETHYLAMINO)ETHYL]-1,4-DIAZEPAN-5-ONE
• 6-AMINO-5-OXO-[1,4]DIAZEPANE-1-CARBOXYLIC ACID BENZYL ESTER
• 4-(4-methoxyphenyl)-1,4-diazepan-2-one
• 1-Phenyl-[1,4]diazepan-5-one
• 1-(2-PHENYLETHYL)-4-(PYRIDIN-2-YLMETHYL)-1,4-DIAZEPAN-5-ONE
• N-[4-OXO-4-(HEXAHYDRO-5-OXO-1,4-DIAZEPIN-1-YL)BUTANOYL]ISOQUINOLINE