methane;bis(pentan-3-one);bis(yttrium)

C11H22O2Y2-2 — CID 159667627

IUPACmethane;bis(pentan-3-one);bis(yttrium)
SMILESC.C[CH-]C(=O)CC.C[CH-]C(=O)CC.[Y].[Y]
InChIInChI=1S/2C5H9O.CH4.2Y/c2*1-3-5(6)4-2;;;/h2*3H,4H2,1-2H3;1H4;;/q2*-1;;;
InChIKeyICPNEYQAWTYONO-UHFFFAOYSA-N
MW364.11 g/mol
LogP3.01
Rot. Bonds4

About methane;bis(pentan-3-one);bis(yttrium)

methane;bis(pentan-3-one);bis(yttrium) (PubChem CID 159667627) has the molecular formula C11H22O2Y2-2 and a molecular weight of 364.11 g/mol. Its IUPAC name is methane;bis(pentan-3-one);bis(yttrium).

Molecular Properties

Compound Namemethane;bis(pentan-3-one);bis(yttrium)
PubChem CID159667627
Molecular FormulaC11H22O2Y2-2
Molecular Weight364.11 g/mol
Exact Mass363.97
IUPAC Namemethane;bis(pentan-3-one);bis(yttrium)
SMILESC.C[CH-]C(=O)CC.C[CH-]C(=O)CC.[Y].[Y]
InChIInChI=1S/2C5H9O.CH4.2Y/c2*1-3-5(6)4-2;;;/h2*3H,4H2,1-2H3;1H4;;/q2*-1;;;
InChIKeyICPNEYQAWTYONO-UHFFFAOYSA-N
XLogP3.01
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.11
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

pentan-3-one;yttrium
CID 59118360
propanoyl (113C)propanoate
CID 91179573
1-aminobutan-2-one;rhenium
CID 163779097
propanoic acid;yttrium
CID 59015039
bis(butan-2-one);methane
CID 160665705
dipentanoyl hexanedioate
CID 174373362
dipropanoyl butanedioate
CID 146216618
methane;propanamide
CID 160666730
butan-2-one;methane;propan-2-one
CID 157260382
zinc;propanoic acid;dichloride
CID 173391175
butan-2-one;methane;propan-2-one
CID 159882043
pentadecanoyl hexadecanoate
CID 87499774

Frequently Asked Questions

What is the IUPAC name of methane;bis(pentan-3-one);bis(yttrium)?
The IUPAC name of methane;bis(pentan-3-one);bis(yttrium) (CID 159667627) is methane;bis(pentan-3-one);bis(yttrium).
What is the SMILES notation for methane;bis(pentan-3-one);bis(yttrium)?
The canonical SMILES for methane;bis(pentan-3-one);bis(yttrium) is C.C[CH-]C(=O)CC.C[CH-]C(=O)CC.[Y].[Y].
What is the InChIKey of methane;bis(pentan-3-one);bis(yttrium)?
The InChIKey is ICPNEYQAWTYONO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H9O.CH4.2Y/c2*1-3-5(6)4-2;;;/h2*3H,4H2,1-2H3;1H4;;/q2*-1;;;.
What are the key properties of methane;bis(pentan-3-one);bis(yttrium)?
methane;bis(pentan-3-one);bis(yttrium) has a molecular weight of 364.11 g/mol, XLogP of 3.01, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;bis(pentan-3-one);bis(yttrium) is sourced from PubChem (CID 159667627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).