1,4,5,8-Tetranitroso-decahydro-pyrazino(2,3-b)pyrazine
Basic information
- CAS
155538-61-7- Standard SMILES
O=NN1CCN(N=O)C2C1N(N=O)CCN2N=O- InChIKey
VEYWUVHJFGHNOC-UHFFFAOYSA-N- Molecular formula
- C6H10N8O4
- Average molar mass
- 258.2 g/mol
- Monoisotopic mass
- 258.08250083
Names & identifiers
- Preferred name
- 1,4,5,8-Tetranitroso-decahydro-pyrazino(2,3-b)pyrazine
- IUPAC
- 1,4,5,8-tetranitroso-2,3,4a,6,7,8a-hexahydropyrazino[2,3-b]pyrazine
Names & synonyms
1,4,5,8-tetranitroso-decahydro-pyrazino(2,3-b)pyrazine1,4,5,8-Tetranitroso-decahydro-pyrazino[2,3-b]pyrazineRefChem:415796155538-61-7683-513-881898-35-3Pyrazino[2,3-b]pyrazine, decahydro-1,4,5,8-tetranitroso-, trans-1,4,5,8-Tetranitrosodecahydropyrazino[2,3-b]pyrazineSCHEMBL10845773SCHEMBL10845783DTXSID80404845AKOS024331695
Database identifiers
- CAS
155538-61-7、81898-35-3- PubChem CID
- 4610282
- DTXSID
DTXSID80404845- EC Number
- 683-513-8
- Nikkaji
- J3.224.650H
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 299
Experimental & physicochemical properties
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
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Related reactions
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Compound notes
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