potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide

C11H9BF3KO — CID 63677244

IUPACpotassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide
SMILESCOc1ccc2ccccc2c1[B-](F)(F)F.[K+]
InChIInChI=1S/C11H9BF3O.K/c1-16-10-7-6-8-4-2-3-5-9(8)11(10)12(13,14)15;/h2-7H,1H3;/q-1;+1
InChIKeyGNKBTLYUIQZITQ-UHFFFAOYSA-N
MW264.10 g/mol
LogP-0.09
Rot. Bonds2

About potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide

potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide (PubChem CID 63677244) has the molecular formula C11H9BF3KO and a molecular weight of 264.10 g/mol. Its IUPAC name is potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide.

Molecular Properties

Compound Namepotassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide
PubChem CID63677244
Molecular FormulaC11H9BF3KO
Molecular Weight264.10 g/mol
Exact Mass264.03
IUPAC Namepotassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide
SMILESCOc1ccc2ccccc2c1[B-](F)(F)F.[K+]
InChIInChI=1S/C11H9BF3O.K/c1-16-10-7-6-8-4-2-3-5-9(8)11(10)12(13,14)15;/h2-7H,1H3;/q-1;+1
InChIKeyGNKBTLYUIQZITQ-UHFFFAOYSA-N
XLogP-0.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.10
LogP ≤ 5-0.09
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

trifluoro-(2-methoxynaphthalen-1-yl)boranuide
CID 63677245
trifluoro-(2-propan-2-yloxynaphthalen-1-yl)boranuide
CID 63677449
(2-butoxynaphthalen-1-yl)-trifluoroboranuide
CID 63677253
potassium trifluoro-[2-(3-methylbut-2-enoxy)naphthalen-1-yl]boranuide
CID 63677250
trifluoro-[2-(2-methylprop-2-enoxy)naphthalen-1-yl]boranuide
CID 63677261
2-methoxy-1-(trimethyl-λ4-selanyl)naphthalene
CID 175262224
2-methoxy-1-(2-methoxynaphthalen-1-yl)oxynaphthalene
CID 168858344
potassium trifluoro-(2-fluoro-6-methoxyphenyl)boranuide
CID 87620756
2-methoxy-1-[2-(2-methoxynaphthalen-1-yl)-3,4,5,6-tetraphenylphenyl]naphthalene
CID 11017918
2-methoxy-1-(trifluoromethoxy)naphthalene
CID 149345741
1-ethoxy-2-methoxynaphthalene
CID 45093938
2-methoxynaphthalene-1-sulfinic acid
CID 1484864

Frequently Asked Questions

What is the IUPAC name of potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide?
The IUPAC name of potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide (CID 63677244) is potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide.
What is the SMILES notation for potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide?
The canonical SMILES for potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide is COc1ccc2ccccc2c1[B-](F)(F)F.[K+].
What is the InChIKey of potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide?
The InChIKey is GNKBTLYUIQZITQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BF3O.K/c1-16-10-7-6-8-4-2-3-5-9(8)11(10)12(13,14)15;/h2-7H,1H3;/q-1;+1.
What are the key properties of potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide?
potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide has a molecular weight of 264.10 g/mol, XLogP of -0.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium trifluoro-(2-methoxynaphthalen-1-yl)boranuide is sourced from PubChem (CID 63677244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).