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Structure

Potassium (2,4-dimethylphenyl)trifluoroborate

CAS
850245-50-0
Catalog Number
ACM850245500
Category
Borate
Molecular Weight
212.062
Molecular Formula
C8H9BF3.K

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Specification

Synonyms
POTASSIUM (2,4-DIMETHYLPHENYL)TRIFLUOROBORATE
IUPAC Name
potassium;(2,4-dimethylphenyl)-trifluoroboranuide
Canonical SMILES
[B-](C1=C(C=C(C=C1)C)C)(F)(F)F.[K+]
InChI Key
BADMHUYSCWLTIM-UHFFFAOYSA-N
Exact Mass
212.03900
H-Bond Acceptor
4
H-Bond Donor
0
What is the IUPAC name of potassium (2,4-dimethylphenyl)trifluoroborate?

The IUPAC name of potassium (2,4-dimethylphenyl)trifluoroborate is "potassium;(2,4-dimethylphenyl)-trifluoroboranuide".

What is the InChI of potassium (2,4-dimethylphenyl)trifluoroborate?

The InChI of potassium (2,4-dimethylphenyl)trifluoroborate is "InChI=1S/C8H9BF3.K/c1-6-3-4-8(7(2)5-6)9(10,11)12;/h3-5H,1-2H3;/q-1;+1".

What is the InChIKey of potassium (2,4-dimethylphenyl)trifluoroborate?

The InChIKey of potassium (2,4-dimethylphenyl)trifluoroborate is "BADMHUYSCWLTIM-UHFFFAOYSA-N".

What is the canonical SMILES of potassium (2,4-dimethylphenyl)trifluoroborate?

The canonical SMILES of potassium (2,4-dimethylphenyl)trifluoroborate is "[B-](C1=C(C=C(C=C1)C)C)(F)(F)F.[K+]".

What is the molecular weight of potassium (2,4-dimethylphenyl)trifluoroborate?

The molecular weight of potassium (2,4-dimethylphenyl)trifluoroborate is 212.06 g/mol.

How many hydrogen bond donor counts does potassium (2,4-dimethylphenyl)trifluoroborate have?

Potassium (2,4-dimethylphenyl)trifluoroborate has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does potassium (2,4-dimethylphenyl)trifluoroborate have?

Potassium (2,4-dimethylphenyl)trifluoroborate has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does potassium (2,4-dimethylphenyl)trifluoroborate have?

Potassium (2,4-dimethylphenyl)trifluoroborate has 0 rotatable bond counts.

What is the exact mass of potassium (2,4-dimethylphenyl)trifluoroborate?

The exact mass of potassium (2,4-dimethylphenyl)trifluoroborate is 212.0386464 g/mol.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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