carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one

C7H5F3O4Rh — CID 135473693

IUPACcarbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one
SMILESC/C(O)=C/C(=O)C(F)(F)F.[C-]#[O+].[C-]#[O+].[Rh]
InChIInChI=1S/C5H5F3O2.2CO.Rh/c1-3(9)2-4(10)5(6,7)8;2*1-2;/h2,9H,1H3;;;/b3-2-;;;
InChIKeyCJCMZZYODMQOAW-GDNGEXCGSA-N
MW313.01 g/mol
LogP1.50
Rot. Bonds1

About carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one

carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one (PubChem CID 135473693) has the molecular formula C7H5F3O4Rh and a molecular weight of 313.01 g/mol. Its IUPAC name is carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one.

Molecular Properties

Compound Namecarbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one
PubChem CID135473693
Molecular FormulaC7H5F3O4Rh
Molecular Weight313.01 g/mol
Exact Mass312.92
IUPAC Namecarbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one
SMILESC/C(O)=C/C(=O)C(F)(F)F.[C-]#[O+].[C-]#[O+].[Rh]
InChIInChI=1S/C5H5F3O2.2CO.Rh/c1-3(9)2-4(10)5(6,7)8;2*1-2;/h2,9H,1H3;;;/b3-2-;;;
InChIKeyCJCMZZYODMQOAW-GDNGEXCGSA-N
XLogP1.50
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.01
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

tris((Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one);praseodymium
CID 6174066
tris(1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one);iron(3+)
CID 159734107
erbium;tris((Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one)
CID 102601436
bis(1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one);nickel;hydrate
CID 118797553
tris((Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one);ytterbium;dihydrate
CID 138375745
copper;bis((Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one);dihydrate
CID 91927752
tris((Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one);yttrium;hydrate
CID 22836400
bis((Z)-4-hydroxypent-3-en-2-one);rhodium
CID 11358512
carbon monoxide;manganese;2,2,2-trifluoroacetic acid
CID 134981507
carbon monoxide;(Z)-3-hydroxy-1-phenylbut-2-en-1-one;rhodium
CID 135473696
(3Z,5E,6E)-1,1,1,8,8-pentafluoro-4-hydroxy-7-methyl-5-prop-2-enylidenedeca-3,6-dien-2-one
CID 162686711
acetic acid;bis(2,2,2-trifluoroacetic acid)
CID 87799840

Frequently Asked Questions

What is the IUPAC name of carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one?
The IUPAC name of carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one (CID 135473693) is carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one.
What is the SMILES notation for carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one?
The canonical SMILES for carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one is C/C(O)=C/C(=O)C(F)(F)F.[C-]#[O+].[C-]#[O+].[Rh].
What is the InChIKey of carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one?
The InChIKey is CJCMZZYODMQOAW-GDNGEXCGSA-N. The full InChI is InChI=1S/C5H5F3O2.2CO.Rh/c1-3(9)2-4(10)5(6,7)8;2*1-2;/h2,9H,1H3;;;/b3-2-;;;.
What are the key properties of carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one?
carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one has a molecular weight of 313.01 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;rhodium;(Z)-1,1,1-trifluoro-4-hydroxypent-3-en-2-one is sourced from PubChem (CID 135473693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).