potassium;hydride;2-methylquinoline;tritetrafluoroborate

C10H10B3F12KN-3 — CID 175190029

IUPACpotassium;hydride;2-methylquinoline;tritetrafluoroborate
SMILESCc1ccc2ccccc2n1.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.[H-].[K+]
InChIInChI=1S/C10H9N.3BF4.K.H/c1-8-6-7-9-4-2-3-5-10(9)11-8;3*2-1(3,4)5;;/h2-7H,1H3;;;;;/q;3*-1;+1;-1
InChIKeyYPUFDNQMHLISEN-UHFFFAOYSA-N
MW443.71 g/mol
LogP3.56
Rot. Bonds

About potassium;hydride;2-methylquinoline;tritetrafluoroborate

potassium;hydride;2-methylquinoline;tritetrafluoroborate (PubChem CID 175190029) has the molecular formula C10H10B3F12KN-3 and a molecular weight of 443.71 g/mol. Its IUPAC name is potassium;hydride;2-methylquinoline;tritetrafluoroborate.

Molecular Properties

Compound Namepotassium;hydride;2-methylquinoline;tritetrafluoroborate
PubChem CID175190029
Molecular FormulaC10H10B3F12KN-3
Molecular Weight443.71 g/mol
Exact Mass444.06
IUPAC Namepotassium;hydride;2-methylquinoline;tritetrafluoroborate
SMILESCc1ccc2ccccc2n1.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.[H-].[K+]
InChIInChI=1S/C10H9N.3BF4.K.H/c1-8-6-7-9-4-2-3-5-10(9)11-8;3*2-1(3,4)5;;/h2-7H,1H3;;;;;/q;3*-1;+1;-1
InChIKeyYPUFDNQMHLISEN-UHFFFAOYSA-N
XLogP3.56
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.71
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;methane;2-methylquinoline
CID 144748871
2-methylquinoline;naphthalene;hydrochloride
CID 175029103
dichloroplatinum;bis(2-methylquinoline)
CID 50909727
dihydroxy(oxo)phosphanium;2-methylquinoline
CID 174867800
2-methylquinoline;pyrimidine
CID 174933863
butane-1,3-diol;2-methylquinoline
CID 141397242
1-chloronaphthalene;2-methylquinoline
CID 175049880
2-methylquinoline;quinoline-2-carboxamide
CID 174829911
bis(2-methylquinoline);triphenylsilyloxyaluminum(2+)
CID 162162913
2-methylbenzo[b][1,8]naphthyridine
CID 118895198
2-(difluoromethyl)-3-methylquinoline
CID 154021471
2-methylbenzo[b][1,10]phenanthroline
CID 11615688

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;2-methylquinoline;tritetrafluoroborate?
The IUPAC name of potassium;hydride;2-methylquinoline;tritetrafluoroborate (CID 175190029) is potassium;hydride;2-methylquinoline;tritetrafluoroborate.
What is the SMILES notation for potassium;hydride;2-methylquinoline;tritetrafluoroborate?
The canonical SMILES for potassium;hydride;2-methylquinoline;tritetrafluoroborate is Cc1ccc2ccccc2n1.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.[H-].[K+].
What is the InChIKey of potassium;hydride;2-methylquinoline;tritetrafluoroborate?
The InChIKey is YPUFDNQMHLISEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N.3BF4.K.H/c1-8-6-7-9-4-2-3-5-10(9)11-8;3*2-1(3,4)5;;/h2-7H,1H3;;;;;/q;3*-1;+1;-1.
What are the key properties of potassium;hydride;2-methylquinoline;tritetrafluoroborate?
potassium;hydride;2-methylquinoline;tritetrafluoroborate has a molecular weight of 443.71 g/mol, XLogP of 3.56, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;2-methylquinoline;tritetrafluoroborate is sourced from PubChem (CID 175190029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).