carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)

C13H21Y — CID 23381602

IUPACcarbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)
SMILESCc1[c-]c(C)c(C)c(C)c1C.[CH3-].[CH3-].[Y+3]
InChIInChI=1S/C11H15.2CH3.Y/c1-7-6-8(2)10(4)11(5)9(7)3;;;/h1-5H3;2*1H3;/q3*-1;+3
InChIKeyXQKYUWRCJIIBTN-UHFFFAOYSA-N
MW266.22 g/mol
LogP3.93
Rot. Bonds

About carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)

carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+) (PubChem CID 23381602) has the molecular formula C13H21Y and a molecular weight of 266.22 g/mol. Its IUPAC name is carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+).

Molecular Properties

Compound Namecarbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)
PubChem CID23381602
Molecular FormulaC13H21Y
Molecular Weight266.22 g/mol
Exact Mass266.07
IUPAC Namecarbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)
SMILESCc1[c-]c(C)c(C)c(C)c1C.[CH3-].[CH3-].[Y+3]
InChIInChI=1S/C11H15.2CH3.Y/c1-7-6-8(2)10(4)11(5)9(7)3;;;/h1-5H3;2*1H3;/q3*-1;+3
InChIKeyXQKYUWRCJIIBTN-UHFFFAOYSA-N
XLogP3.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.22
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 54528607
CID 154723318
CID 154723318
(4E)-2,3,4,5-tetramethylhepta-2,4-diene
CID 18738646
1,4-Dimethylbenzene-3,5-diide;undecakis(yttrium)
CID 20593650
Carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;tungsten;vanadium(2+)
CID 20614941
Carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;vanadium(2+)
CID 20672733
1,4-Dimethylbenzene-3,5-diide;heptakis(yttrium)
CID 21053143
CID 21304539
CID 21304539
Lithium 1,2,3,4,5-pentamethylbenzene-6-ide
CID 21335191

Frequently Asked Questions

What is the IUPAC name of carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)?
The IUPAC name of carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+) (CID 23381602) is carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+).
What is the SMILES notation for carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)?
The canonical SMILES for carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+) is Cc1[c-]c(C)c(C)c(C)c1C.[CH3-].[CH3-].[Y+3].
What is the InChIKey of carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)?
The InChIKey is XQKYUWRCJIIBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15.2CH3.Y/c1-7-6-8(2)10(4)11(5)9(7)3;;;/h1-5H3;2*1H3;/q3*-1;+3.
What are the key properties of carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+)?
carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+) has a molecular weight of 266.22 g/mol, XLogP of 3.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;yttrium(3+) is sourced from PubChem (CID 23381602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).