2-(dimethylamino)benzenediazonium tetrafluoroborate

C8H10BF4N3 — CID 88706755

IUPAC2-(dimethylamino)benzenediazonium tetrafluoroborate
SMILESCN(C)c1ccccc1[N+]#N.F[B-](F)(F)F
InChIInChI=1S/C8H10N3.BF4/c1-11(2)8-6-4-3-5-7(8)10-9;2-1(3,4)5/h3-6H,1-2H3;/q+1;-1
InChIKeyBKMIQDLFZBGAEC-UHFFFAOYSA-N
MW234.99 g/mol
LogP3.54
Rot. Bonds1

About 2-(dimethylamino)benzenediazonium tetrafluoroborate

2-(dimethylamino)benzenediazonium tetrafluoroborate (PubChem CID 88706755) has the molecular formula C8H10BF4N3 and a molecular weight of 234.99 g/mol. Its IUPAC name is 2-(dimethylamino)benzenediazonium tetrafluoroborate.

Molecular Properties

Compound Name2-(dimethylamino)benzenediazonium tetrafluoroborate
PubChem CID88706755
Molecular FormulaC8H10BF4N3
Molecular Weight234.99 g/mol
Exact Mass235.09
IUPAC Name2-(dimethylamino)benzenediazonium tetrafluoroborate
SMILESCN(C)c1ccccc1[N+]#N.F[B-](F)(F)F
InChIInChI=1S/C8H10N3.BF4/c1-11(2)8-6-4-3-5-7(8)10-9;2-1(3,4)5/h3-6H,1-2H3;/q+1;-1
InChIKeyBKMIQDLFZBGAEC-UHFFFAOYSA-N
XLogP3.54
TPSA31.39 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.99
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-(dichloroamino)benzenediazonium tetrafluoroborate
CID 21219859
2-(diethylamino)benzenediazonium
CID 21446526
zinc;2-(diethylamino)benzenediazonium;trichloride
CID 21446527
benzene-1,2-didiazonium
CID 22568635
2-[[(E)-6-hydroxyhex-2-enyl]-methylsulfonylamino]benzenediazonium tetrafluoroborate
CID 11068998
benzenediazonium tetratetrafluoroborate
CID 19876590
(N-diazonioanilino)benzene hexatetrafluoroborate
CID 173037932
2,3-dimethoxybenzenediazonium tetratetrafluoroborate
CID 173431119
[2-(dimethylamino)phenyl] carbamate
CID 163610116
2-chloro-3-fluorobenzenediazonium tetrafluoroborate
CID 87707531
hexafluoroantimony(1-);2-methylbenzenediazonium
CID 134895028
2-fluorobenzenediazonium fluoride
CID 14451953

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)benzenediazonium tetrafluoroborate?
The IUPAC name of 2-(dimethylamino)benzenediazonium tetrafluoroborate (CID 88706755) is 2-(dimethylamino)benzenediazonium tetrafluoroborate.
What is the SMILES notation for 2-(dimethylamino)benzenediazonium tetrafluoroborate?
The canonical SMILES for 2-(dimethylamino)benzenediazonium tetrafluoroborate is CN(C)c1ccccc1[N+]#N.F[B-](F)(F)F.
What is the InChIKey of 2-(dimethylamino)benzenediazonium tetrafluoroborate?
The InChIKey is BKMIQDLFZBGAEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N3.BF4/c1-11(2)8-6-4-3-5-7(8)10-9;2-1(3,4)5/h3-6H,1-2H3;/q+1;-1.
What are the key properties of 2-(dimethylamino)benzenediazonium tetrafluoroborate?
2-(dimethylamino)benzenediazonium tetrafluoroborate has a molecular weight of 234.99 g/mol, XLogP of 3.54, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)benzenediazonium tetrafluoroborate is sourced from PubChem (CID 88706755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).