carbanide;methylbenzene;propane;yttrium

C11H18Y-2 — CID 157106806

IUPACcarbanide;methylbenzene;propane;yttrium
SMILESCCC.Cc1c[c-]ccc1.[CH3-].[Y]
InChIInChI=1S/C7H7.C3H8.CH3.Y/c1-7-5-3-2-4-6-7;1-3-2;;/h2-3,5-6H,1H3;3H2,1-2H3;1H3;/q-1;;-1;
InChIKeyMFIKYZHTXSEVLR-UHFFFAOYSA-N
MW239.17 g/mol
LogP3.66
Rot. Bonds

About carbanide;methylbenzene;propane;yttrium

carbanide;methylbenzene;propane;yttrium (PubChem CID 157106806) has the molecular formula C11H18Y-2 and a molecular weight of 239.17 g/mol. Its IUPAC name is carbanide;methylbenzene;propane;yttrium.

Molecular Properties

Compound Namecarbanide;methylbenzene;propane;yttrium
PubChem CID157106806
Molecular FormulaC11H18Y-2
Molecular Weight239.17 g/mol
Exact Mass239.05
IUPAC Namecarbanide;methylbenzene;propane;yttrium
SMILESCCC.Cc1c[c-]ccc1.[CH3-].[Y]
InChIInChI=1S/C7H7.C3H8.CH3.Y/c1-7-5-3-2-4-6-7;1-3-2;;/h2-3,5-6H,1H3;3H2,1-2H3;1H3;/q-1;;-1;
InChIKeyMFIKYZHTXSEVLR-UHFFFAOYSA-N
XLogP3.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.17
LogP ≤ 53.66
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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methylbenzene;methylbenzene;rutherfordium
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methylbenzene;bis(5-methylcyclopenta-1,3-diene);titanium(4+)
CID 141033478
carbanide;methane;methylbenzene;methylbenzene;methylbenzene;tris(yttrium)
CID 161381388
carbanide;ethane;ethylbenzene;yttrium
CID 154652507
benzene;carbanide;toluene;tungsten(2+)
CID 143728683
bis(cyclopenta-1,3-diene);methylbenzene;titanium(4+)
CID 174442197

Frequently Asked Questions

What is the IUPAC name of carbanide;methylbenzene;propane;yttrium?
The IUPAC name of carbanide;methylbenzene;propane;yttrium (CID 157106806) is carbanide;methylbenzene;propane;yttrium.
What is the SMILES notation for carbanide;methylbenzene;propane;yttrium?
The canonical SMILES for carbanide;methylbenzene;propane;yttrium is CCC.Cc1c[c-]ccc1.[CH3-].[Y].
What is the InChIKey of carbanide;methylbenzene;propane;yttrium?
The InChIKey is MFIKYZHTXSEVLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7.C3H8.CH3.Y/c1-7-5-3-2-4-6-7;1-3-2;;/h2-3,5-6H,1H3;3H2,1-2H3;1H3;/q-1;;-1;.
What are the key properties of carbanide;methylbenzene;propane;yttrium?
carbanide;methylbenzene;propane;yttrium has a molecular weight of 239.17 g/mol, XLogP of 3.66, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;methylbenzene;propane;yttrium is sourced from PubChem (CID 157106806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).