6E3

2,3,5,6-tetramethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione

Created:	2016-03-19
Last modified:	2024-09-27

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2 entries where 6E3 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	0
Bond Count	27
Aromatic Bond Count	0

2D diagram of 6E3

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Chemical Component Summary
Name	2,3,5,6-tetramethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione
Systematic Name (OpenEye OEToolkits)	1,2,6,7-tetramethylpyrazolo[1,2-a]pyrazole-3,5-dione
Formula	C₁₀ H₁₂ N₂ O₂
Molecular Weight	192.214
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C1C(=C(C)N2N1C(C(C)=C2C)=O)C
SMILES	CACTVS	3.385	CC1=C(C)C(=O)N2N1C(=C(C)C2=O)C
SMILES	OpenEye OEToolkits	2.0.4	CC1=C(N2C(=C(C(=O)N2C1=O)C)C)C
Canonical SMILES	CACTVS	3.385	CC1=C(C)C(=O)N2N1C(=C(C)C2=O)C
Canonical SMILES	OpenEye OEToolkits	2.0.4	CC1=C(N2C(=C(C(=O)N2C1=O)C)C)C
InChI	InChI	1.03	InChI=1S/C10H12N2O2/c1-5-7(3)11-8(4)6(2)10(14)12(11)9(5)13/h1-4H3
InChIKey	InChI	1.03	VWKNUUOGGLNRNZ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	12445118
ChEBI	CHEBI:62828
CCDC/CSD	TMZBCO11, TMZBCO10

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