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

Catalog Number	ACM35138228-2
CAS	35138-22-8
Structure
Synonyms	Bis(cycloocta-1,5-diene)rhodium(I) tetrafluoroborate
IUPAC Name	(1Z,5Z)-cycloocta-1,5-diene;rhodium;tetrafluoroborate;
Molecular Weight	406.07
Molecular Formula	C16H24BF4Rh
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
Purity	99%
Appearance	Orange red crystalline powder
Application	Asymmetric Reactions; C-H Activation; Hydroformylation; Hydrogenation→Asymmetric Hydrogenation; Hydrosilylation; Isomerization;
Storage	Refrigerator (+4°C)
Complexity	91.7
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
EC Number	460-220-1
Exact Mass	406.09621
Formal Charge	-1
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
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	0
Topological Polar Surface Area	0 Ų

Q&A

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.