N,N'-Carbonyldiimidazole | CAS No. 530-62-1

N,N'-Carbonyldiimidazole

Basic Information

CAS Number

530-62-1

Molecular Formula

C7H6N4O

Molecular Weight

162.15 g/mol

EINECS

208-488-9

AD

Basic Physical Properties

Physical State

White to light cream

Melting Point

117-122 °C

Boiling Point

288.83°C (rough estimate)

Density

1.303 g/mL at 25 °C

Water Solubility

Insoluble in water

Flash Point

192.5±23.2 °C

Solubility

Soluble in dimethylformamide.

Refractive Index

n20/D1.434

Vapor Pressure

0.006-0.012Pa at 20-25℃

C1=CN(C=N1)C(=O)N2C=CN=C2

InChI

InChI=1S/C7H6N4O/c12-7(10-3-1-8-5-10)11-4-2-9-6-11/h1-6H

InChIKey

PFKFTWBEEFSNDU-UHFFFAOYSA-N

LogP

0.5959999999999999

pKa

2.90±0.10(Predicted)

Topological Polar Surface Area

52.71 Ų

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

166

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302
H314H314

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Toxicity

LD50 orally in Rabbit: 1071 mg/kg

Synonyms & References

English

  • Carbonyl-1,1'-diimidazole
  • 1,1'-cabonyldiimidazole
  • 1,1'-carbonyldiimdazole
  • n,n'-carbonyl diimidazole
  • cabonyldiimidazole
  • F0001-1366
  • P17515
  • W-200555
  • 1,1'carbonyl diimidazole
  • NS00007612
  • carbonyldimidazole
  • carbonyldiirnidazole
  • N,N-carbonyidiimidazole
  • Carbonyidiimidazole
  • 1-(1H-Imidazol-1-ylcarbonyl)-1H-imidazole #
  • CDL
  • di(imidazol-1-yl)methanone
  • 1,1' carbonyl diimidazole
  • Q418617
  • Imidazole, 1,1'-carbonyldi-
  • NSC-67203
  • US9138393, 1?-1- Carbonylimidazole
  • 1,1'-carbonyl-diimidazole
  • 1,1'-carbonyldi-imidazole
  • Diimidazol-1-yl ketone
  • Carbonyl diimidazole
  • 1,1' -carbonyldiimidazole
  • 1,1'-Carbonyl di-imidazole
  • AC-10610
  • di-1h-imidazol-1-yl-methanone
  • CHEMBL3903881

MDL Number

MFCD00005286

EC Number

208-488-9

Customs Code

29332990

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