2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)

C134H174Y2-4 — CID 160651688

IUPAC2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1c2ccccc2c(C)c2ccccc12.Cc1c[c-]c(-c2[c-]cc(C)cc2)cc1.Cc1cc[c-]c(-c2[c-]ccc(C)c2)c1.Cc1ccc(C)c2ccccc12.Cc1ccc(C)cc1.Cc1ccc2cc(C)ccc2c1.Cc1ccc2cc3cc(C)ccc3cc2c1.Cc1cccc(C)c1.Cc1cccc2c(C)cccc12.[Y].[Y]
InChIInChI=1S/2C16H14.2C14H12.3C12H12.2C8H10.11C2H6.2Y/c1-11-3-5-13-10-16-8-12(2)4-6-14(16)9-15(13)7-11;1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-11-5-3-7-13(9-11)14-8-4-6-12(2)10-14;1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-9-5-3-8-12-10(2)6-4-7-11(9)12;1-9-7-8-10(2)12-6-4-3-5-11(9)12;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;11*1-2;;/h2*3-10H,1-2H3;3-7,9H,1-2H3;3-6,9-10H,1-2H3;3*3-8H,1-2H3;2*3-6H,1-2H3;11*1-2H3;;/q;;2*-2;;;;;;;;;;;;;;;;;;
InChIKeyPCKXYCPYDAVOEQ-UHFFFAOYSA-N
MW1962.68 g/mol
LogP42.62
Rot. Bonds2

About 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)

2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium) (PubChem CID 160651688) has the molecular formula C134H174Y2-4 and a molecular weight of 1962.68 g/mol. Its IUPAC name is 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium).

Molecular Properties

Compound Name2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)
PubChem CID160651688
Molecular FormulaC134H174Y2-4
Molecular Weight1962.68 g/mol
Exact Mass1961.18
IUPAC Name2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1c2ccccc2c(C)c2ccccc12.Cc1c[c-]c(-c2[c-]cc(C)cc2)cc1.Cc1cc[c-]c(-c2[c-]ccc(C)c2)c1.Cc1ccc(C)c2ccccc12.Cc1ccc(C)cc1.Cc1ccc2cc(C)ccc2c1.Cc1ccc2cc3cc(C)ccc3cc2c1.Cc1cccc(C)c1.Cc1cccc2c(C)cccc12.[Y].[Y]
InChIInChI=1S/2C16H14.2C14H12.3C12H12.2C8H10.11C2H6.2Y/c1-11-3-5-13-10-16-8-12(2)4-6-14(16)9-15(13)7-11;1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-11-5-3-7-13(9-11)14-8-4-6-12(2)10-14;1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-9-5-3-8-12-10(2)6-4-7-11(9)12;1-9-7-8-10(2)12-6-4-3-5-11(9)12;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;11*1-2;;/h2*3-10H,1-2H3;3-7,9H,1-2H3;3-6,9-10H,1-2H3;3*3-8H,1-2H3;2*3-6H,1-2H3;11*1-2H3;;/q;;2*-2;;;;;;;;;;;;;;;;;;
InChIKeyPCKXYCPYDAVOEQ-UHFFFAOYSA-N
XLogP42.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001962.68
LogP ≤ 542.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium) with MolForge

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Related Compounds

2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;2,5-dimethylpyridine;ethane;1-methyl-3-(4-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)
CID 160997034
2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1,3-xylene;1,4-xylene
CID 157392918
2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1,2-xylene;1,3-xylene;1,4-xylene
CID 162072402
ethane;1-methyl-3-phenylbenzene-4-ide;1-methyl-4-phenylbenzene-5-ide;(yttrium)
CID 157288339
1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;1,2,3,4,5,6-hexamethylbenzene;1-methyl-4-(4-methylphenyl)benzene;1,2,4,5-tetramethylbenzene;1,2-xylene;1,3-xylene;1,4-xylene
CID 161126825
ethane;1-methyl-3-(3-methylbenzene-2-id-1-yl)benzene-2-ide;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;tris(yttrium)
CID 158718781
1,3-dimethylnaphthalene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1,2-xylene;1,3-xylene;1,4-xylene
CID 158627561
1,4-dimethylanthracene;2,6-dimethylanthracene;9,10-dimethylanthracene;2,3-dimethylnaphthalene;2,7-dimethylnaphthalene;ethane
CID 161265902
1-chloro-2,4-dimethylbenzene;2-chloro-1,4-dimethylbenzene;1,4-dimethylnaphthalene;2,6-dimethylnaphthalene;1-methyl-4-(4-methylphenyl)benzene;1,2,3-trimethylbenzene;bis(1,2,4-trimethylbenzene);1,3-xylene;1,4-xylene
CID 160565395
ethane;2-(2-methylbenzene-6-id-1-yl)-1H-naphthalen-1-ide;2-(3-methylbenzene-2-id-1-yl)-1H-naphthalen-1-ide;2-(3-methylbenzene-6-id-1-yl)-1H-naphthalen-1-ide;2-(4-methylbenzene-6-id-1-yl)-1H-naphthalen-1-ide;4-methyl-1-(2H-naphthalen-2-id-1-yl)-2H-naphthalen-2-ide;4-methyl-1-(3H-naphthalen-3-id-2-yl)-2H-naphthalen-2-ide;4-methyl-1-phenyl-2H-naphthalen-2-ide;(yttrium)
CID 161319785
9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,7-dimethylpyrene;1-methyl-4-(4-methylphenyl)benzene
CID 159442583
ethane;6-methylchrysene;1-methyl-3-phenylbenzene-4-ide;yttrium
CID 158954289

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)?
The IUPAC name of 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium) (CID 160651688) is 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium).
What is the SMILES notation for 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)?
The canonical SMILES for 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1c2ccccc2c(C)c2ccccc12.Cc1c[c-]c(-c2[c-]cc(C)cc2)cc1.Cc1cc[c-]c(-c2[c-]ccc(C)c2)c1.Cc1ccc(C)c2ccccc12.Cc1ccc(C)cc1.Cc1ccc2cc(C)ccc2c1.Cc1ccc2cc3cc(C)ccc3cc2c1.Cc1cccc(C)c1.Cc1cccc2c(C)cccc12.[Y].[Y].
What is the InChIKey of 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)?
The InChIKey is PCKXYCPYDAVOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H14.2C14H12.3C12H12.2C8H10.11C2H6.2Y/c1-11-3-5-13-10-16-8-12(2)4-6-14(16)9-15(13)7-11;1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-11-5-3-7-13(9-11)14-8-4-6-12(2)10-14;1-9-3-5-12-8-10(2)4-6-11(12)7-9;1-9-5-3-8-12-10(2)6-4-7-11(9)12;1-9-7-8-10(2)12-6-4-3-5-11(9)12;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;11*1-2;;/h2*3-10H,1-2H3;3-7,9H,1-2H3;3-6,9-10H,1-2H3;3*3-8H,1-2H3;2*3-6H,1-2H3;11*1-2H3;;/q;;2*-2;;;;;;;;;;;;;;;;;;.
What are the key properties of 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium)?
2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium) has a molecular weight of 1962.68 g/mol, XLogP of 42.62, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylanthracene;9,10-dimethylanthracene;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;ethane;1-methyl-3-(3-methylbenzene-6-id-1-yl)benzene-4-ide;1-methyl-4-(4-methylbenzene-6-id-1-yl)benzene-5-ide;1,3-xylene;1,4-xylene;bis(yttrium) is sourced from PubChem (CID 160651688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).