Triazabicyclodecene

CAS 5807-14-7  ·  C7H13N3  ·  MW 139.20 g/mol

Full record: Triazabicyclodecene — Safety Data Sheet →

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3D model Triazabicyclodecene, CAS 5807-14-7, molecular formula C7H13N3, molar mass 139.20 g/mol

Model views

  • Triazabicyclodecene (CAS 5807-14-7) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • Triazabicyclodecene (CAS 5807-14-7) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • Triazabicyclodecene (CAS 5807-14-7) – 2D structure, MolGod Viewer
    2D structure

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About Triazabicyclodecene

Triazabicyclodecene is a chemical compound registered under number CAS 5807-14-7, with the molecular formula C7H13N3, and a molar mass of 139.20 g/mol.

The molecule contains 23 atoms connected by 24 chemical bonds. The full systematic IUPAC name of this compound is 3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = -0.3 (negative value, a hydrophilic compound), polar surface area PSA = 27.6 Ų, 1 donors and 1 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC7H13N3
Molar mass139.20 g/mol
IUPAC3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine
SMILESC1CNC2=NCCCN2C1
InChIKeyFVKFHMNJTHKMRX-UHFFFAOYSA-N
logP (XLogP3)-0.3
PSA27.6 Ų
HBD / HBA1 / 1
PubChem CIDCID 79873 ↗
GHS safety

Signal word: Danger

GHS05
GHS05

H314 — Causes severe skin burns and eye damage

Scientific literature

Brak articles naukowych dla CAS 5807-14-7 w PubMed / OpenAlex / Semantic Scholar.

Synonyms
Triazabicyclodecene · KAF7GN82TM · TBD compound · RefChem:933318 · 5807-14-7 · 1,5,7-Triazabicyclo[4.4.0]dec-5-ene · 1,3,4,6,7,8-Hexahydro-2H-pyrimido[1,2-a]pyrimidine · Hhpp · 2,3,4,6,7,8-Hexahydro-1H-pyrimido[1,2-a]pyrimidine · 3,4,6,7,8,9-hexahydro-2H-pyrimido[1,2-a]pyrimidine · 1,3,4,6,7,8-Hexahydro-2H-pyrimido(1,2-a)pyrimidine · MFCD00043003 · 2H-Pyrimido[1,2-a]pyrimidine, 1,3,4,6,7,8-hexahydro- · 1,5,7-triazabicyclo(4.4.0)dec-5-ene · 1H,2H,3H,4H,6H,7H,8H-[1,3]diazino[1,2-a]pyrimidine
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
Triazabicyclodecene · 5807-14-7
InChIKey
FVKFHMNJTHKMRX-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Triazabicyclodecene (CAS 5807-14-7)
License & provenance record
Triazabicyclodecene (CAS 5807-14-7) →
MolGod molecule record
Triazabicyclodecene →
Source data
PubChem CID 79873 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
48d42bccbbf97f0b8ce00aaf67606b3d9dd90f823079bcd149902fcb48c47e9b
MD5 (STL)
8a1c0f5a5513e730a646164c165cf3e7
MolGod Identification Number
MG_845-826-642-14
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
STL · PNG
Free printable molecule model
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This 3D model is also published on: Zenodo (DOI 10.5281/zenodo.23954218) · Wikimedia Commons
Included in datasets: Hugging Face · OSF project index
Source structure: PubChem (CID 79873)
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