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CID 457791

HCID 457791
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
16998-92-8
Standard SMILES
C[B-]1(C)n2ccc[n+]2[B-](C)(C)n2ccc[n+]21
InChIKey
FQKONKJRKPASKT-UHFFFAOYSA-N
Molecular formula
C10H18B2N4
Average molar mass
215.9 g/mol
Monoisotopic mass
216.1717569

Names & identifiers

Preferred name
CID 457791
IUPAC
2,2,8,8-tetramethyl-3,9-diaza-1,7-diazonia-2,8-diboranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,10-tetraene
English name
1 3 5 7-Tetramethylpyrazabole 98
Molecular formula
C10H18B2N4
Molecular weight
215.9

Names & synonyms

16998-92-8NSC3764442,2,8,8-Tetramethyl-3,9-diaza-1,7-diazonia-2,8-diboranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,10-tetraeneDTXSID30332462Boron, tetramethylbis[.mu.-(1H-pyrazolato-.kappa.N1:.kappa.N2)]di-1 3 5 7-Tetramethylpyrazabole 981 3 5 7-TETRAMETHYLPYRAZABOLE 98%

Database identifiers

CAS
16998-92-8
PubChem CID
457791
DTXSID
DTXSID30332462

Properties

Computed structural properties

Topological polar surface area
17.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
16
Formal charge
0
Complexity
253

Physicochemical properties

Melting point
185 °C · 185 °C
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
3

Chemistry & industry

Suppliers3 total

SIGMA—
Service Chemical Inc.[email protected]
SIGMAALDRICH—

Related reactions

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Compound notes

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