Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate

CAS
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CAS
113119-46-3
Size
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Purity
>98.0%(LC)
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Catalog Number

ACM113119463

Product Name

Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate

Structure

Structure

CAS

113119-46-3

Category

Micro/NanoElectronics

Synonyms

BIS(2,4,6-TRIMETHYLPYRIDINE)IODINE(I) HEXAFLUOROPHOSPHATE;BIS(2,4,6-TRIMETHYLPYRIDINE)IODONIUM HEXAFLUOROPHOSPHATE;BIS(2,4,6-TRIMETHYLPYRIDINE)IODINE(I) HEXAFLUORO PHOSPHATE 99+%;Bis(2,4,6-trimethylpyridine)iodine(I) hexafluorophosphate 97%

IUPAC Name

bis(2,4,6-trimethylpyridin-3-yl)iodanium;hexafluorophosphate

Molecular Weight

512.21g/mol

Molecular Formula

C16H20F6IN2P

Canonical SMILES

CC1=CC(=NC(=C1[I+]C2=C(N=C(C=C2C)C)C)C)C.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C16H20IN2.F6P/c1-9-7-11(3)18-13(5)15(9)17-16-10(2)8-12(4)19-14(16)6;1-7(2,3,4,5)6/h7-8H,1-6H3;/q+1;-1

InChI Key

ZQFVHVVVDAIMQV-UHFFFAOYSA-N

Complexity

331

Covalently-Bonded Unit Count

2

Exact Mass

512.0313g/mol

Formal Charge

0

H-Bond Acceptor

9

H-Bond Donor

0

Heavy Atom Count

26

Monoisotopic Mass

512.0313g/mol

Rotatable Bond Count

2

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The molecular formula is C16H20F6IN2P.

What is the molecular weight of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The molecular weight is 512.21 g/mol.

What is the IUPAC name of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The IUPAC name is bis(2,4,6-trimethylpyridin-3-yl)iodanium;hexafluorophosphate.

What is the InChI of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The InChI is InChI=1S/C16H20IN2.F6P/c1-9-7-11(3)18-13(5)15(9)17-16-10(2)8-12(4)19-14(16)6;1-7(2,3,4,5)6/h7-8H,1-6H3;/q+1;-1.

What is the InChIKey of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The InChIKey is ZQFVHVVVDAIMQV-UHFFFAOYSA-N.

What is the canonical SMILES of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The canonical SMILES is CC1=CC(=NC(=C1[I+]C2=C(N=C(C=C2C)C)C)C)C.F[P-](F)(F)(F)(F)F.

What is the CAS number of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The CAS number is 113119-46-3.

What is the European Community (EC) number of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The European Community (EC) number is 623-373-7.

What is the hydrogen bond donor count of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The hydrogen bond donor count is 0.

What is the hydrogen bond acceptor count of Bis(2,4,6-trimethylpyridine)iodine(i)hexafluorophosphate?

The hydrogen bond acceptor count is 9.

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