3-Oxo-13-oxa-2,5,7,9,11-pentaazatetracyclo[10.3.1.02,10.04,8]hexadeca-4(8),6,10,14-tetraene-15-carbaldehyde

Modify Date: 2025-09-08 17:24:04

3-Oxo-13-oxa-2,5,7,9,11-pentaazatetracyclo[10.3.1.02,10.04,8]hexadeca-4(8),6,10,14-tetraene-15-carbaldehyde Structure
3-Oxo-13-oxa-2,5,7,9,11-pentaazatetracyclo[10.3.1.02,10.04,8]hexadeca-4(8),6,10,14-tetraene-15-carbaldehyde structure
Common Name 3-Oxo-13-oxa-2,5,7,9,11-pentaazatetracyclo[10.3.1.02,10.04,8]hexadeca-4(8),6,10,14-tetraene-15-carbaldehyde
CAS Number 138555-45-0 Molecular Weight 259.22100
Density 2.1±0.1 g/cm3 Boiling Point 629.3±65.0 °C at 760 mmHg
Molecular Formula C11H9N5O3 Melting Point N/A
MSDS N/A Flash Point 334.4±34.3 °C

 Names

Name 3-Oxo-13-oxa-2,5,7,9,11-pentaazatetracyclo[10.3.1.02,10.04,8]hexadeca-4(8),6,10,14-tetraene-15-carbaldehyde
Synonym More Synonyms

 Chemical & Physical Properties

Density 2.1±0.1 g/cm3
Boiling Point 629.3±65.0 °C at 760 mmHg
Molecular Formula C11H9N5O3
Molecular Weight 259.22100
Flash Point 334.4±34.3 °C
Exact Mass 259.07100
PSA 105.13000
LogP -1.95
Vapour Pressure 0.0±1.8 mmHg at 25°C
Index of Refraction 1.979
InChIKey VDTZMEQMORWBRT-UHFFFAOYSA-N
SMILES O=CC1=COC2CC1n1c(nc3nc[nH]c3c1=O)N2

 Synonyms

6,10-Methano-10H-[1,3,5]oxadiazocino[5,4-a]purine-9-carboxaldehyde,1,4,6,12-tetrahydro-12-oxo
6,10-Methano-10H-[1,3,5]oxadiazocino[5,4-a]purine-9-carboxaldehyde, 1,4,6,12-tetrahydro-12-oxo-
3-Oxo-13-oxa-2,5,7,9,11-pentaazatetracyclo[10.3.1.0.0]hexadeca-4(8),6,10,14-tetraene-15-carbaldehyde
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