2-ethyl-9,10-dimethylideneanthracene

C18H16 — CID 142246344

IUPAC2-ethyl-9,10-dimethylideneanthracene
SMILESC=c1c2ccccc2c(=C)c2cc(CC)ccc12
InChIInChI=1S/C18H16/c1-4-14-9-10-17-12(2)15-7-5-6-8-16(15)13(3)18(17)11-14/h5-11H,2-4H2,1H3
InChIKeyJQEIEXDIHPXIOO-UHFFFAOYSA-N
MW232.33 g/mol
LogP3.38
Rot. Bonds1

About 2-ethyl-9,10-dimethylideneanthracene

2-ethyl-9,10-dimethylideneanthracene (PubChem CID 142246344) has the molecular formula C18H16 and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-ethyl-9,10-dimethylideneanthracene.

Molecular Properties

Compound Name2-ethyl-9,10-dimethylideneanthracene
PubChem CID142246344
Molecular FormulaC18H16
Molecular Weight232.33 g/mol
Exact Mass232.13
IUPAC Name2-ethyl-9,10-dimethylideneanthracene
SMILESC=c1c2ccccc2c(=C)c2cc(CC)ccc12
InChIInChI=1S/C18H16/c1-4-14-9-10-17-12(2)15-7-5-6-8-16(15)13(3)18(17)11-14/h5-11H,2-4H2,1H3
InChIKeyJQEIEXDIHPXIOO-UHFFFAOYSA-N
XLogP3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 53.38
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

2-ethyl-9,10-dimethylanthracene;methane
CID 157065860
2-ethyl-9,10-bis[(2-methylpropan-2-yl)oxy]anthracene
CID 139929966
2-ethyl-9,10-diphenoxyanthracene
CID 139904651
2-ethyl-9,10-bis[(4-ethylphenyl)methoxy]anthracene
CID 158794171
3-ethyldibenzofuran
CID 58510747
ethane;2-ethyltriphenylene;9H-fluorene
CID 158463433
7,9-diethylbenzo[a]anthracene
CID 91740932
2-ethyl-9-methylcarbazole
CID 71038255
9,10-bis(9,9-dimethylfluoren-2-yl)-2-ethylanthracene
CID 58019447
2-ethyl-9,10-bis(ethylsulfanylmethoxy)anthracene
CID 139902073
2-ethyl-9,10-di(nonoxy)anthracene
CID 139930282
2-ethyl-10-phenylanthracen-9-ol
CID 71405477

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-9,10-dimethylideneanthracene?
The IUPAC name of 2-ethyl-9,10-dimethylideneanthracene (CID 142246344) is 2-ethyl-9,10-dimethylideneanthracene.
What is the SMILES notation for 2-ethyl-9,10-dimethylideneanthracene?
The canonical SMILES for 2-ethyl-9,10-dimethylideneanthracene is C=c1c2ccccc2c(=C)c2cc(CC)ccc12.
What is the InChIKey of 2-ethyl-9,10-dimethylideneanthracene?
The InChIKey is JQEIEXDIHPXIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16/c1-4-14-9-10-17-12(2)15-7-5-6-8-16(15)13(3)18(17)11-14/h5-11H,2-4H2,1H3.
What are the key properties of 2-ethyl-9,10-dimethylideneanthracene?
2-ethyl-9,10-dimethylideneanthracene has a molecular weight of 232.33 g/mol, XLogP of 3.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-9,10-dimethylideneanthracene is sourced from PubChem (CID 142246344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).