Bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate

CAS

35138-22-8

Catalog Number

ACM35138228-2

Category

Rhodium series of catalysts

Molecular Weight

406.07

Molecular Formula

C16H24BF4Rh

MSDS COA Spec Sheet

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Specification

Synonyms

Bis(cycloocta-1,5-diene)rhodium(I) tetrafluoroborate

IUPAC Name

(1Z,5Z)-cycloocta-1,5-diene;rhodium;tetrafluoroborate;

Canonical SMILES

[B-](F)(F)(F)F.C1CC=CCCC=C1.C1CC=CCCC=C1.[Rh]

InChI

InChI=1S/2C8H12.BF4.Rh/c2*1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h2*1-2,7-8H,3-6H2;/q;-1;/b2*2-1-,8-7-;

InChI Key

LYXHWHHENVLYCN-QMDOQEJBSA-N

Melting Point

210 °C

Appearance

Orange red crystalline powder

Application

Asymmetric Reactions; C-H Activation; Hydroformylation; Hydrogenation→Asymmetric Hydrogenation; Hydrosilylation; Isomerization;

Storage

Refrigerator (+4°C)

Color/Form

powder

Complexity

91.7

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

EC Number

460-220-1

Exact Mass

406.09621

Formal Charge

-1

H-Bond Acceptor

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isomeric SMILES

[B-](F)(F)(F)F.C1/C=C\CC/C=C\C1.C1/C=C\CC/C=C\C1.[Rh]

Monoisotopic Mass

406.09621

Rotatable Bond Count

Topological Polar Surface Area

0 Å²

What is the molecular formula of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The molecular formula is C16H24BF4Rh.

What is the molecular weight of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The molecular weight is 406.1 g/mol.

What are the synonyms for Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The synonyms include Bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate, [rh(cod)2]bf4, and Bis(1,5-cyclooctadiene)rhodium(I)tetrafluoroborate.

When was Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate created?

It was created on July 19, 2005.

When was Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate last modified?

It was last modified on December 30, 2023.

What is the IUPAC Name of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The IUPAC Name is (1Z,5Z)-cycloocta-1,5-diene;rhodium;tetrafluoroborate.

What is the InChI of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The InChI is InChI=1S/2C8H12.BF4.Rh/c2*1-2-4-6-8-7-5-3-1;2-1(3,4)5;/h2*1-2,7-8H,3-6H2;;/q;;-1;/b2*2-1-,8-7-;;.

What is the InChIKey of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The InChIKey is LYXHWHHENVLYCN-QMDOQEJBSA-N.

What is the canonical SMILES of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The canonical SMILES is [B-](F)(F)(F)F.C1CC=CCCC=C1.C1CC=CCCC=C1.[Rh].

What is the molecular weight of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate according to PubChem?

The molecular weight is 406.1 g/mol according to PubChem.

How many hydrogen bond donor counts does Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate have?

It has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate have?

It has 5 hydrogen bond acceptor counts.

What is the topological polar surface area of Bis(1,5-cyclooctadiene)rhodium(I) Tetrafluoroborate?

The topological polar surface area is 0-2.