10-ethoxy-10H-anthracen-9-one

C16H14O2 — CID 163685880

IUPAC10-ethoxy-10H-anthracen-9-one
SMILESCCOC1c2ccccc2C(=O)c2ccccc21
InChIInChI=1S/C16H14O2/c1-2-18-16-13-9-5-3-7-11(13)15(17)12-8-4-6-10-14(12)16/h3-10,16H,2H2,1H3
InChIKeyJOVQNRSZOXJYOX-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.36
Rot. Bonds2

About 10-ethoxy-10H-anthracen-9-one

10-ethoxy-10H-anthracen-9-one (PubChem CID 163685880) has the molecular formula C16H14O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 10-ethoxy-10H-anthracen-9-one.

Molecular Properties

Compound Name10-ethoxy-10H-anthracen-9-one
PubChem CID163685880
Molecular FormulaC16H14O2
Molecular Weight238.29 g/mol
Exact Mass238.10
IUPAC Name10-ethoxy-10H-anthracen-9-one
SMILESCCOC1c2ccccc2C(=O)c2ccccc21
InChIInChI=1S/C16H14O2/c1-2-18-16-13-9-5-3-7-11(13)15(17)12-8-4-6-10-14(12)16/h3-10,16H,2H2,1H3
InChIKeyJOVQNRSZOXJYOX-UHFFFAOYSA-N
XLogP3.36
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-ethoxy-10H-anthracen-9-one?
The IUPAC name of 10-ethoxy-10H-anthracen-9-one (CID 163685880) is 10-ethoxy-10H-anthracen-9-one.
What is the SMILES notation for 10-ethoxy-10H-anthracen-9-one?
The canonical SMILES for 10-ethoxy-10H-anthracen-9-one is CCOC1c2ccccc2C(=O)c2ccccc21.
What is the InChIKey of 10-ethoxy-10H-anthracen-9-one?
The InChIKey is JOVQNRSZOXJYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O2/c1-2-18-16-13-9-5-3-7-11(13)15(17)12-8-4-6-10-14(12)16/h3-10,16H,2H2,1H3.
What are the key properties of 10-ethoxy-10H-anthracen-9-one?
10-ethoxy-10H-anthracen-9-one has a molecular weight of 238.29 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethoxy-10H-anthracen-9-one is sourced from PubChem (CID 163685880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).