hydron;triethyl(methyl)azanium;tetrafluoroborate

C7H19BF4N+ — CID 87302670

IUPAChydron;triethyl(methyl)azanium;tetrafluoroborate
SMILESCC[N+](C)(CC)CC.F[B-](F)(F)F.[H+]
InChIInChI=1S/C7H18N.BF4/c1-5-8(4,6-2)7-3;2-1(3,4)5/h5-7H2,1-4H3;/q+1;-1/p+1
InChIKeyOHZMHURLSZDGTO-UHFFFAOYSA-O
MW204.04 g/mol
LogP2.91
Rot. Bonds3

About hydron;triethyl(methyl)azanium;tetrafluoroborate

hydron;triethyl(methyl)azanium;tetrafluoroborate (PubChem CID 87302670) has the molecular formula C7H19BF4N+ and a molecular weight of 204.04 g/mol. Its IUPAC name is hydron;triethyl(methyl)azanium;tetrafluoroborate.

Molecular Properties

Compound Namehydron;triethyl(methyl)azanium;tetrafluoroborate
PubChem CID87302670
Molecular FormulaC7H19BF4N+
Molecular Weight204.04 g/mol
Exact Mass204.15
IUPAC Namehydron;triethyl(methyl)azanium;tetrafluoroborate
SMILESCC[N+](C)(CC)CC.F[B-](F)(F)F.[H+]
InChIInChI=1S/C7H18N.BF4/c1-5-8(4,6-2)7-3;2-1(3,4)5/h5-7H2,1-4H3;/q+1;-1/p+1
InChIKeyOHZMHURLSZDGTO-UHFFFAOYSA-O
XLogP2.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.04
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

bromo(trifluoro)boranuide;triethyl(methyl)azanium
CID 140836561
dibutyl-ethyl-methylazanium;hydron;tetrafluoroborate
CID 174806932
bromo(trichloro)boranuide;triethyl(methyl)azanium
CID 140836548
ethane;tetraethylazanium;octatetrafluoroborate
CID 173127151
triethyl(methyl)azanium iodate
CID 158535675
tetramethylazanium tetrafluoroborate
CID 12621
triethyl(methyl)azanium;trifluoro borate;iodide
CID 175209505
perchloric acid;triethyl(methyl)azanium
CID 87764447
ethyl-dimethyl-phenylazanium tetrafluoroborate
CID 139243462
methanesulfonic acid;triethyl(methyl)azanium
CID 87743130
(Z)-but-2-enedioic acid;triethyl(methyl)azanium
CID 87389837
cyano(triethyl)azanium tetrafluoroborate
CID 22564450

Frequently Asked Questions

What is the IUPAC name of hydron;triethyl(methyl)azanium;tetrafluoroborate?
The IUPAC name of hydron;triethyl(methyl)azanium;tetrafluoroborate (CID 87302670) is hydron;triethyl(methyl)azanium;tetrafluoroborate.
What is the SMILES notation for hydron;triethyl(methyl)azanium;tetrafluoroborate?
The canonical SMILES for hydron;triethyl(methyl)azanium;tetrafluoroborate is CC[N+](C)(CC)CC.F[B-](F)(F)F.[H+].
What is the InChIKey of hydron;triethyl(methyl)azanium;tetrafluoroborate?
The InChIKey is OHZMHURLSZDGTO-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H18N.BF4/c1-5-8(4,6-2)7-3;2-1(3,4)5/h5-7H2,1-4H3;/q+1;-1/p+1.
What are the key properties of hydron;triethyl(methyl)azanium;tetrafluoroborate?
hydron;triethyl(methyl)azanium;tetrafluoroborate has a molecular weight of 204.04 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;triethyl(methyl)azanium;tetrafluoroborate is sourced from PubChem (CID 87302670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).