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Substance Name: 1,8-Diazabicyclo(5.4.0)undec-7-ene
RN: 6674-22-2
UNII: H1ILJ6IBUX
InChIKey: GQHTUMJGOHRCHB-UHFFFAOYSA-N

Molecular Formula

  • C9-H16-N2

Molecular Weight

  • 152.2394
 
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Names and Synonyms

Name of Substance

  • 1,8-Diazabicyclo(5.4.0)undec-7-ene

Synonyms

  • 1,5-Diazabicyclo(5.4.0)undec-5-ene
  • 1,8-Diazabicyclo(5.4.0)undec-7-ene
  • 2,3,4,6,7,8,9,10-Octahydropyrimido(1,2-alpha)azepine
  • CCRIS 9417
  • DBU
  • EC 229-713-7
  • EINECS 229-713-7
  • NSC 111184
  • NSC 230466
  • Polycat DBU
  • UNII-H1ILJ6IBUX

Systematic Names

  • 1,8-Diazabicyclo(5.4.0)undec-7-ene
  • Pyrimido(1,2-a)azepine, 2,3,4,6,7,8,9,10-octahydro-

Registry Numbers

CAS Registry Number

  • 6674-22-2

FDA UNII

  • H1ILJ6IBUX

Other Registry Numbers

  • 31171-04-7
  • 41015-70-7
  • 51301-56-5
  • 69722-76-5
  • 78995-63-8
  • 83329-50-4

System Generated Number

  • 0006674222

Structure Descriptors

InChI

1S/C9H16N2/c1-2-5-9-10-6-4-8-11(9)7-3-1/h1-8H2

InChIKey

GQHTUMJGOHRCHB-UHFFFAOYSA-N

Smiles

N1=C2N(CCCCC2)CCC1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.38 (none)   EXP
Water Solubility 4920 mg/L 25 EST
Vapor Pressure 0.055 mm Hg 25 EST
Henry's Law Constant 1.93E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.56E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.