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2-(1H-7-Azabenzotriazol-1-yl)-1,1,3,3-tetramethyl uronium hexafluorophosphate Methanaminium

HCID 86621144
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)C(On1nnc2cccnc21)=[N+](C)C.C[NH3+].F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F
InChIKey
ACIDGFCGLFMOON-UHFFFAOYSA-O
Molecular formula
C11H21F12N7OP2
Average molar mass
557.26 g/mol

Names & identifiers

Preferred name
2-(1H-7-Azabenzotriazol-1-yl)-1,1,3,3-tetramethyl uronium hexafluorophosphate Methanaminium
IUPAC
[dimethylamino(triazolo[4,5-b]pyridin-3-yloxy)methylidene]-dimethylazanium;methylazanium;dihexafluorophosphate

Names & synonyms

2-(1H-7-Azabenzotriazol-1-yl)-1,1,3,3-tetramethyl uronium hexafluorophosphate MethanaminiumACIDGFCGLFMOON-UHFFFAOYSA-O2-(1H-7-azabenzo triazol-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphate methanaminium2-(1H-7-azabenzotriazol 1-yl)-1,1,3,3-tetramethyl uronium hexafluorophosphate methanaminium2-(1H-7-azabenzotriazol-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphate methanaminium2-(1H-7-Azabenzotriazol-1-yl)--1,1,3,3-tetramethyl uronium hexafluorophosphate Methanaminium2-(1H-7-azabenzotriazol-1-yl)-1,1,3,3-tetra methyl uronium hexafluorophosphate methanaminium

Database identifiers

PubChem CID
86621144

Properties

Computed structural properties

Topological polar surface area
86.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
18
Rotatable bonds
3
Heavy atoms
33
Formal charge
0
Complexity
353

Related reactions

88 records
New reaction record
HRID 44501 reaction equation
HRID 44501As reactantuspto-grants-2013_09
HRID 241424 reaction equation
HRID 241424As reactantuspto-grants-2014_02
HRID 385294 reaction equation
HRID 385294As reactantuspto-grants-2013_02
HRID 385296 reaction equation
HRID 385296As reactantuspto-grants-2013_02
HRID 453305 reaction equation
HRID 453305As reactantuspto-grants-2013_07
HRID 470720 reaction equation
HRID 470720As reactantuspto-grants-2014_01
HRID 470723 reaction equation
HRID 470723As reactantuspto-grants-2014_01
HRID 510153 reaction equation
HRID 510153As reactantuspto-grants-2015_08
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Compound notes

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