(4-methylcyclohexyl)benzene;bis(yttrium)

C13H17Y2- — CID 18720966

IUPAC(4-methylcyclohexyl)benzene;bis(yttrium)
SMILESCC1CCC(c2cc[c-]cc2)CC1.[Y].[Y]
InChIInChI=1S/C13H17.2Y/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;;/h3-6,11,13H,7-10H2,1H3;;/q-1;;
InChIKeyYKIVAJUPORIKRV-UHFFFAOYSA-N
MW351.09 g/mol
LogP3.78
Rot. Bonds1

About (4-methylcyclohexyl)benzene;bis(yttrium)

(4-methylcyclohexyl)benzene;bis(yttrium) (PubChem CID 18720966) has the molecular formula C13H17Y2- and a molecular weight of 351.09 g/mol. Its IUPAC name is (4-methylcyclohexyl)benzene;bis(yttrium).

Molecular Properties

Compound Name(4-methylcyclohexyl)benzene;bis(yttrium)
PubChem CID18720966
Molecular FormulaC13H17Y2-
Molecular Weight351.09 g/mol
Exact Mass350.95
IUPAC Name(4-methylcyclohexyl)benzene;bis(yttrium)
SMILESCC1CCC(c2cc[c-]cc2)CC1.[Y].[Y]
InChIInChI=1S/C13H17.2Y/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;;/h3-6,11,13H,7-10H2,1H3;;/q-1;;
InChIKeyYKIVAJUPORIKRV-UHFFFAOYSA-N
XLogP3.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.09
LogP ≤ 53.78
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

(4-methylcyclohexyl)benzene;yttrium(3+)
CID 18720907
1-(4-methylcyclohexyl)-4-phenylbenzene;yttrium(3+)
CID 18720903
1-(4-methylcyclohexyl)-4-(4-phenylbutyl)benzene;yttrium(3+)
CID 18720895
1-fluoro-3-(4-methylcyclohexyl)benzene-6-ide;bis(yttrium)
CID 18720964
1-[difluoro(phenoxy)methyl]-4-(4-methylcyclohexyl)benzene;yttrium(3+)
CID 18720938
cyclohexylbenzene;titanium;trihydrochloride
CID 173441767
1-bromo-4-(4-methylcyclohexyl)benzene
CID 21137228
4-(4-methylcyclohexyl)benzonitrile
CID 18464047
1-methoxy-4-(4-methylcyclohexyl)benzene;hydrate
CID 144745908
[4-(4-ethenylcyclohexyl)cyclohexyl]benzene;(4-methylcyclohexyl)benzene;4-(4-methylcyclohexyl)cyclohexan-1-ol;1-methyl-4-phenylbenzene;4-(4-methylphenyl)phenol;pentakis(yttrium)
CID 159979273
1-(4-methylcyclohexyl)-4-phenylbenzene
CID 18720904
1-fluoro-4-(4-methylcyclohexyl)benzene;molecular hydrogen
CID 158127728

Frequently Asked Questions

What is the IUPAC name of (4-methylcyclohexyl)benzene;bis(yttrium)?
The IUPAC name of (4-methylcyclohexyl)benzene;bis(yttrium) (CID 18720966) is (4-methylcyclohexyl)benzene;bis(yttrium).
What is the SMILES notation for (4-methylcyclohexyl)benzene;bis(yttrium)?
The canonical SMILES for (4-methylcyclohexyl)benzene;bis(yttrium) is CC1CCC(c2cc[c-]cc2)CC1.[Y].[Y].
What is the InChIKey of (4-methylcyclohexyl)benzene;bis(yttrium)?
The InChIKey is YKIVAJUPORIKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17.2Y/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;;/h3-6,11,13H,7-10H2,1H3;;/q-1;;.
What are the key properties of (4-methylcyclohexyl)benzene;bis(yttrium)?
(4-methylcyclohexyl)benzene;bis(yttrium) has a molecular weight of 351.09 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylcyclohexyl)benzene;bis(yttrium) is sourced from PubChem (CID 18720966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).