palladium;pentan-2-one

C5H10OPd — CID 174766041

IUPACpalladium;pentan-2-one
SMILESCCCC(C)=O.[Pd]
InChIInChI=1S/C5H10O.Pd/c1-3-4-5(2)6;/h3-4H2,1-2H3;
InChIKeyPQUIRTNFVWMBKD-UHFFFAOYSA-N
MW192.55 g/mol
LogP1.37
Rot. Bonds2

About palladium;pentan-2-one

palladium;pentan-2-one (PubChem CID 174766041) has the molecular formula C5H10OPd and a molecular weight of 192.55 g/mol. Its IUPAC name is palladium;pentan-2-one.

Molecular Properties

Compound Namepalladium;pentan-2-one
PubChem CID174766041
Molecular FormulaC5H10OPd
Molecular Weight192.55 g/mol
Exact Mass191.98
IUPAC Namepalladium;pentan-2-one
SMILESCCCC(C)=O.[Pd]
InChIInChI=1S/C5H10O.Pd/c1-3-4-5(2)6;/h3-4H2,1-2H3;
InChIKeyPQUIRTNFVWMBKD-UHFFFAOYSA-N
XLogP1.37
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.55
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

pentan-2-one;zinc
CID 88629307
CID 171375174
CID 171375174
CID 158726547
CID 158726547
butane-2,3-dione;pentan-2-one
CID 160941626
tris(butan-2-one);tris(pentan-2-one)
CID 157203121
pentan-2-one;propanoic acid
CID 162011313
oxetane;pentan-2-one
CID 159710624
2-methylbutan-2-ol;pentan-2-one
CID 88715177
2-methylprop-2-enoic acid;pentan-2-one
CID 159816457
oxolane;pentan-2-one
CID 174917924
bromoethane;hexadecane;pentan-2-one
CID 19601871
hexane-2,5-dione
CID 8035

Frequently Asked Questions

What is the IUPAC name of palladium;pentan-2-one?
The IUPAC name of palladium;pentan-2-one (CID 174766041) is palladium;pentan-2-one.
What is the SMILES notation for palladium;pentan-2-one?
The canonical SMILES for palladium;pentan-2-one is CCCC(C)=O.[Pd].
What is the InChIKey of palladium;pentan-2-one?
The InChIKey is PQUIRTNFVWMBKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O.Pd/c1-3-4-5(2)6;/h3-4H2,1-2H3;.
What are the key properties of palladium;pentan-2-one?
palladium;pentan-2-one has a molecular weight of 192.55 g/mol, XLogP of 1.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for palladium;pentan-2-one is sourced from PubChem (CID 174766041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).