1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium

C24H14Y-2 — CID 58813435

IUPAC1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium
SMILES[Y].[c-]1ccc2ccccc2c1-c1[c-]ccc2cc3ccccc3cc12
InChIInChI=1S/C24H14.Y/c1-2-9-19-16-24-20(15-18(19)8-1)11-6-14-23(24)22-13-5-10-17-7-3-4-12-21(17)22;/h1-12,15-16H;/q-2;
InChIKeyLNIKEWJAOUCFOS-UHFFFAOYSA-N
MW391.28 g/mol
LogP6.41
Rot. Bonds1

About 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium

1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium (PubChem CID 58813435) has the molecular formula C24H14Y-2 and a molecular weight of 391.28 g/mol. Its IUPAC name is 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium.

Molecular Properties

Compound Name1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium
PubChem CID58813435
Molecular FormulaC24H14Y-2
Molecular Weight391.28 g/mol
Exact Mass391.02
IUPAC Name1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium
SMILES[Y].[c-]1ccc2ccccc2c1-c1[c-]ccc2cc3ccccc3cc12
InChIInChI=1S/C24H14.Y/c1-2-9-19-16-24-20(15-18(19)8-1)11-6-14-23(24)22-13-5-10-17-7-3-4-12-21(17)22;/h1-12,15-16H;/q-2;
InChIKeyLNIKEWJAOUCFOS-UHFFFAOYSA-N
XLogP6.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.28
LogP ≤ 56.41
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'}

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Related Compounds

1-(10H-phenanthren-10-id-9-yl)-2H-anthracen-2-ide;yttrium
CID 58813461
3-(2H-tetracen-2-id-1-yl)-2H-pentacen-2-ide;yttrium
CID 58813694
2-(2H-anthracen-2-id-1-yl)-1,3-dihydropyrrol-3-ide;yttrium
CID 58813445
2-(2H-pentacen-2-id-1-yl)-1,3-dihydropyrrol-3-ide;yttrium
CID 58813566
2-(2H-naphthalen-2-id-1-yl)-3H-furan-3-ide;yttrium
CID 58813865
3-(2H-tetracen-2-id-1-yl)-2H-pyridin-2-ide;yttrium
CID 58813892
2-(2H-anthracen-2-id-1-yl)-1H-pentacen-1-ide;yttrium
CID 58813824
4-methyl-1-(2H-naphthalen-2-id-1-yl)-2H-naphthalen-2-ide;(yttrium)
CID 164804327
1-(1H-anthracen-1-id-2-yl)-2H-anthracen-2-ide;1-(3H-anthracen-3-id-2-yl)-2H-anthracen-2-ide;1-(2H-anthracen-2-id-1-yl)-2H-pentacen-2-ide;2-(2H-anthracen-2-id-1-yl)-1H-pentacen-1-ide;3-(2H-anthracen-2-id-1-yl)-2H-pentacen-2-ide;1-(2H-anthracen-2-id-1-yl)-2H-tetracen-2-ide;2-(2H-anthracen-2-id-1-yl)-1H-tetracen-1-ide;3-(2H-anthracen-2-id-1-yl)-2H-tetracen-2-ide;ethane;octakis(yttrium)
CID 159293080
3-(2H-naphthalen-2-id-1-yl)-2H-furan-2-ide;yttrium
CID 58813794
heptacyclo[16.12.0.02,15.04,13.06,11.020,29.021,26]triaconta-1(30),2,4,6,8,10,12,14,16,18,20(29),21,23,25,27-pentadecaene
CID 21087911
CID 157090523
CID 157090523

Frequently Asked Questions

What is the IUPAC name of 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium?
The IUPAC name of 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium (CID 58813435) is 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium.
What is the SMILES notation for 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium?
The canonical SMILES for 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium is [Y].[c-]1ccc2ccccc2c1-c1[c-]ccc2cc3ccccc3cc12.
What is the InChIKey of 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium?
The InChIKey is LNIKEWJAOUCFOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H14.Y/c1-2-9-19-16-24-20(15-18(19)8-1)11-6-14-23(24)22-13-5-10-17-7-3-4-12-21(17)22;/h1-12,15-16H;/q-2;.
What are the key properties of 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium?
1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium has a molecular weight of 391.28 g/mol, XLogP of 6.41, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2H-naphthalen-2-id-1-yl)-2H-anthracen-2-ide;yttrium is sourced from PubChem (CID 58813435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).