9-ethyl-9,10,10-trimethylanthracene

C19H22 — CID 91063128

IUPAC9-ethyl-9,10,10-trimethylanthracene
SMILESCCC1(C)c2ccccc2C(C)(C)c2ccccc21
InChIInChI=1S/C19H22/c1-5-19(4)16-12-8-6-10-14(16)18(2,3)15-11-7-9-13-17(15)19/h6-13H,5H2,1-4H3
InChIKeyIQKPOTHJPIXJBW-UHFFFAOYSA-N
MW250.39 g/mol
LogP5.04
Rot. Bonds1

About 9-ethyl-9,10,10-trimethylanthracene

9-ethyl-9,10,10-trimethylanthracene (PubChem CID 91063128) has the molecular formula C19H22 and a molecular weight of 250.39 g/mol. Its IUPAC name is 9-ethyl-9,10,10-trimethylanthracene.

Molecular Properties

Compound Name9-ethyl-9,10,10-trimethylanthracene
PubChem CID91063128
Molecular FormulaC19H22
Molecular Weight250.39 g/mol
Exact Mass250.17
IUPAC Name9-ethyl-9,10,10-trimethylanthracene
SMILESCCC1(C)c2ccccc2C(C)(C)c2ccccc21
InChIInChI=1S/C19H22/c1-5-19(4)16-12-8-6-10-14(16)18(2,3)15-11-7-9-13-17(15)19/h6-13H,5H2,1-4H3
InChIKeyIQKPOTHJPIXJBW-UHFFFAOYSA-N
XLogP5.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.39
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-9,10,10-trimethylanthracene?
The IUPAC name of 9-ethyl-9,10,10-trimethylanthracene (CID 91063128) is 9-ethyl-9,10,10-trimethylanthracene.
What is the SMILES notation for 9-ethyl-9,10,10-trimethylanthracene?
The canonical SMILES for 9-ethyl-9,10,10-trimethylanthracene is CCC1(C)c2ccccc2C(C)(C)c2ccccc21.
What is the InChIKey of 9-ethyl-9,10,10-trimethylanthracene?
The InChIKey is IQKPOTHJPIXJBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22/c1-5-19(4)16-12-8-6-10-14(16)18(2,3)15-11-7-9-13-17(15)19/h6-13H,5H2,1-4H3.
What are the key properties of 9-ethyl-9,10,10-trimethylanthracene?
9-ethyl-9,10,10-trimethylanthracene has a molecular weight of 250.39 g/mol, XLogP of 5.04, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-9,10,10-trimethylanthracene is sourced from PubChem (CID 91063128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).