1,2-dimethylcyclohexane;yttrium

C8H15Y- — CID 59098035

IUPAC1,2-dimethylcyclohexane;yttrium
SMILESCC1C[CH-]CCC1C.[Y]
InChIInChI=1S/C8H15.Y/c1-7-5-3-4-6-8(7)2;/h3,7-8H,4-6H2,1-2H3;/q-1;
InChIKeyBLSQRKSHOYYFIM-UHFFFAOYSA-N
MW200.11 g/mol
LogP2.64
Rot. Bonds

About 1,2-dimethylcyclohexane;yttrium

1,2-dimethylcyclohexane;yttrium (PubChem CID 59098035) has the molecular formula C8H15Y- and a molecular weight of 200.11 g/mol. Its IUPAC name is 1,2-dimethylcyclohexane;yttrium.

Molecular Properties

Compound Name1,2-dimethylcyclohexane;yttrium
PubChem CID59098035
Molecular FormulaC8H15Y-
Molecular Weight200.11 g/mol
Exact Mass200.02
IUPAC Name1,2-dimethylcyclohexane;yttrium
SMILESCC1C[CH-]CCC1C.[Y]
InChIInChI=1S/C8H15.Y/c1-7-5-3-4-6-8(7)2;/h3,7-8H,4-6H2,1-2H3;/q-1;
InChIKeyBLSQRKSHOYYFIM-UHFFFAOYSA-N
XLogP2.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.11
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,2-dimethylcyclohexane;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

magnesium;methylcyclopentane;bromide
CID 20561687
methylcyclohexane;rhenium
CID 164573339
1-cyclohexyl-4-methylcyclohexane;bis(yttrium)
CID 18720967
CID 161153214
CID 161153214
1,2-dimethylcyclohexane;ethane;tungsten;yttrium
CID 165106256
calcium methanidylcyclopentane
CID 58794036
bromozinc(1+);methylcyclohexane
CID 133144590
1,2-dimethylcyclohexane;vanadium
CID 142004480
1,2-dimethylcyclobutane;2-methylpropane
CID 143728444
1,2-dimethylcycloicosane
CID 123296856
1,2-dimethylcyclononadecane
CID 123549851
ethane;trans-(1R,2R)-1,2-dimethylcyclopentane
CID 91129712

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylcyclohexane;yttrium?
The IUPAC name of 1,2-dimethylcyclohexane;yttrium (CID 59098035) is 1,2-dimethylcyclohexane;yttrium.
What is the SMILES notation for 1,2-dimethylcyclohexane;yttrium?
The canonical SMILES for 1,2-dimethylcyclohexane;yttrium is CC1C[CH-]CCC1C.[Y].
What is the InChIKey of 1,2-dimethylcyclohexane;yttrium?
The InChIKey is BLSQRKSHOYYFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15.Y/c1-7-5-3-4-6-8(7)2;/h3,7-8H,4-6H2,1-2H3;/q-1;.
What are the key properties of 1,2-dimethylcyclohexane;yttrium?
1,2-dimethylcyclohexane;yttrium has a molecular weight of 200.11 g/mol, XLogP of 2.64, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylcyclohexane;yttrium is sourced from PubChem (CID 59098035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).