ethane;2,3,9,10-tetramethylanthracene

C24H36 — CID 143843330

IUPACethane;2,3,9,10-tetramethylanthracene
SMILESCC.CC.CC.Cc1cc2c(C)c3ccccc3c(C)c2cc1C
InChIInChI=1S/C18H18.3C2H6/c1-11-9-17-13(3)15-7-5-6-8-16(15)14(4)18(17)10-12(11)2;3*1-2/h5-10H,1-4H3;3*1-2H3
InChIKeyXBSKNXICOWLKMK-UHFFFAOYSA-N
MW324.55 g/mol
LogP8.31
Rot. Bonds

About ethane;2,3,9,10-tetramethylanthracene

ethane;2,3,9,10-tetramethylanthracene (PubChem CID 143843330) has the molecular formula C24H36 and a molecular weight of 324.55 g/mol. Its IUPAC name is ethane;2,3,9,10-tetramethylanthracene.

Molecular Properties

Compound Nameethane;2,3,9,10-tetramethylanthracene
PubChem CID143843330
Molecular FormulaC24H36
Molecular Weight324.55 g/mol
Exact Mass324.28
IUPAC Nameethane;2,3,9,10-tetramethylanthracene
SMILESCC.CC.CC.Cc1cc2c(C)c3ccccc3c(C)c2cc1C
InChIInChI=1S/C18H18.3C2H6/c1-11-9-17-13(3)15-7-5-6-8-16(15)14(4)18(17)10-12(11)2;3*1-2/h5-10H,1-4H3;3*1-2H3
InChIKeyXBSKNXICOWLKMK-UHFFFAOYSA-N
XLogP8.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.55
LogP ≤ 58.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

6,13-dimethylpentacene;ethane
CID 123724624
9,10-dimethylanthracene;1,4-dimethylnaphthalene;methane
CID 160811650
9,10-dimethylanthracene;bis(9-methylanthracene)
CID 159714317
ethane;9-methylanthracene;naphthalene
CID 161226057
4,5,10,11-tetramethylhexacyclo[12.12.0.02,7.08,13.015,20.021,26]hexacosa-1,3,5,7,9,11,13,15,17,19,21,23,25-tridecaene
CID 164808812
5,13-dimethylpentacene;ethane
CID 144696296
(10-methylanthracen-9-yl)phosphane
CID 163731977
2,9,10-trimethylphenanthrene
CID 11345039
9,10-diphenylanthracene;ethane;9-methyl-10-phenylanthracene
CID 143856164
2-ethyl-9,10-dimethylanthracene;methane
CID 157065860
9,10-dimethylanthracene-2-carbaldehyde
CID 135149055
5,6,7,12,13,14-hexamethylpentacene
CID 20682938

Frequently Asked Questions

What is the IUPAC name of ethane;2,3,9,10-tetramethylanthracene?
The IUPAC name of ethane;2,3,9,10-tetramethylanthracene (CID 143843330) is ethane;2,3,9,10-tetramethylanthracene.
What is the SMILES notation for ethane;2,3,9,10-tetramethylanthracene?
The canonical SMILES for ethane;2,3,9,10-tetramethylanthracene is CC.CC.CC.Cc1cc2c(C)c3ccccc3c(C)c2cc1C.
What is the InChIKey of ethane;2,3,9,10-tetramethylanthracene?
The InChIKey is XBSKNXICOWLKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18.3C2H6/c1-11-9-17-13(3)15-7-5-6-8-16(15)14(4)18(17)10-12(11)2;3*1-2/h5-10H,1-4H3;3*1-2H3.
What are the key properties of ethane;2,3,9,10-tetramethylanthracene?
ethane;2,3,9,10-tetramethylanthracene has a molecular weight of 324.55 g/mol, XLogP of 8.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,3,9,10-tetramethylanthracene is sourced from PubChem (CID 143843330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).