formaldehyde;rhodium;bis(triphenylphosphane);chloride

C37H32ClOP2Rh- — CID 53486327

IUPACformaldehyde;rhodium;bis(triphenylphosphane);chloride
SMILESC=O.[Cl-].[Rh].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15P.CH2O.ClH.Rh/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;;/h2*1-15H;1H2;1H;/p-1
InChIKeyHPWKFRMRYWEJBC-UHFFFAOYSA-M
MW692.97 g/mol
LogP3.71
Rot. Bonds6

About formaldehyde;rhodium;bis(triphenylphosphane);chloride

formaldehyde;rhodium;bis(triphenylphosphane);chloride (PubChem CID 53486327) has the molecular formula C37H32ClOP2Rh- and a molecular weight of 692.97 g/mol. Its IUPAC name is formaldehyde;rhodium;bis(triphenylphosphane);chloride.

Molecular Properties

Compound Nameformaldehyde;rhodium;bis(triphenylphosphane);chloride
PubChem CID53486327
Molecular FormulaC37H32ClOP2Rh-
Molecular Weight692.97 g/mol
Exact Mass692.07
IUPAC Nameformaldehyde;rhodium;bis(triphenylphosphane);chloride
SMILESC=O.[Cl-].[Rh].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15P.CH2O.ClH.Rh/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;;/h2*1-15H;1H2;1H;/p-1
InChIKeyHPWKFRMRYWEJBC-UHFFFAOYSA-M
XLogP3.71
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms42
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500692.97
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

formaldehyde;hydride;rhodium;tris(triphenylphosphane)
CID 53486328
cobalt;formaldehyde;triphenylphosphane
CID 173310038
triphenylphosphane;yttrium
CID 139917776
chlororuthenium(1+);formaldehyde;tris(triphenylphosphane)
CID 21268968
rhodium(3+);nonakis(triphenylphosphane);trichloride
CID 173040367
ruthenium(2+);tetrakis(triphenylphosphane);dichloride
CID 46940376
phosphanium;tris(triphenylphosphane);chloride
CID 160938283
ruthenium(2+);triphenylphosphane;chloride
CID 56645241
triphenylphosphane
CID 139056248
ethene;platinum;triphenylphosphane
CID 11071312
rhenium;bis(triphenylphosphane);trichloride;hydrate
CID 131675016
chlororuthenium(1+);formaldehyde;nitroxyl anion;bis(triphenylphosphane)
CID 21271333

Frequently Asked Questions

What is the IUPAC name of formaldehyde;rhodium;bis(triphenylphosphane);chloride?
The IUPAC name of formaldehyde;rhodium;bis(triphenylphosphane);chloride (CID 53486327) is formaldehyde;rhodium;bis(triphenylphosphane);chloride.
What is the SMILES notation for formaldehyde;rhodium;bis(triphenylphosphane);chloride?
The canonical SMILES for formaldehyde;rhodium;bis(triphenylphosphane);chloride is C=O.[Cl-].[Rh].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of formaldehyde;rhodium;bis(triphenylphosphane);chloride?
The InChIKey is HPWKFRMRYWEJBC-UHFFFAOYSA-M. The full InChI is InChI=1S/2C18H15P.CH2O.ClH.Rh/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2;;/h2*1-15H;1H2;1H;/p-1.
What are the key properties of formaldehyde;rhodium;bis(triphenylphosphane);chloride?
formaldehyde;rhodium;bis(triphenylphosphane);chloride has a molecular weight of 692.97 g/mol, XLogP of 3.71, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;rhodium;bis(triphenylphosphane);chloride is sourced from PubChem (CID 53486327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).