9-(2-ethoxyethoxymethyl)anthracene

C19H20O2 — CID 22345017

IUPAC9-(2-ethoxyethoxymethyl)anthracene
SMILESCCOCCOCc1c2ccccc2cc2ccccc12
InChIInChI=1S/C19H20O2/c1-2-20-11-12-21-14-19-17-9-5-3-7-15(17)13-16-8-4-6-10-18(16)19/h3-10,13H,2,11-12,14H2,1H3
InChIKeyLHHMQJIQUUNIPO-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.55
Rot. Bonds6

About 9-(2-ethoxyethoxymethyl)anthracene

9-(2-ethoxyethoxymethyl)anthracene (PubChem CID 22345017) has the molecular formula C19H20O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 9-(2-ethoxyethoxymethyl)anthracene.

Molecular Properties

Compound Name9-(2-ethoxyethoxymethyl)anthracene
PubChem CID22345017
Molecular FormulaC19H20O2
Molecular Weight280.37 g/mol
Exact Mass280.15
IUPAC Name9-(2-ethoxyethoxymethyl)anthracene
SMILESCCOCCOCc1c2ccccc2cc2ccccc12
InChIInChI=1S/C19H20O2/c1-2-20-11-12-21-14-19-17-9-5-3-7-15(17)13-16-8-4-6-10-18(16)19/h3-10,13H,2,11-12,14H2,1H3
InChIKeyLHHMQJIQUUNIPO-UHFFFAOYSA-N
XLogP4.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-(2-ethoxyethoxymethyl)anthracene?
The IUPAC name of 9-(2-ethoxyethoxymethyl)anthracene (CID 22345017) is 9-(2-ethoxyethoxymethyl)anthracene.
What is the SMILES notation for 9-(2-ethoxyethoxymethyl)anthracene?
The canonical SMILES for 9-(2-ethoxyethoxymethyl)anthracene is CCOCCOCc1c2ccccc2cc2ccccc12.
What is the InChIKey of 9-(2-ethoxyethoxymethyl)anthracene?
The InChIKey is LHHMQJIQUUNIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O2/c1-2-20-11-12-21-14-19-17-9-5-3-7-15(17)13-16-8-4-6-10-18(16)19/h3-10,13H,2,11-12,14H2,1H3.
What are the key properties of 9-(2-ethoxyethoxymethyl)anthracene?
9-(2-ethoxyethoxymethyl)anthracene has a molecular weight of 280.37 g/mol, XLogP of 4.55, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-ethoxyethoxymethyl)anthracene is sourced from PubChem (CID 22345017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).