9-(2-fluoroethyl)-10-methylanthracene

C17H15F — CID 13283739

IUPAC9-(2-fluoroethyl)-10-methylanthracene
SMILESCc1c2ccccc2c(CCF)c2ccccc12
InChIInChI=1S/C17H15F/c1-12-13-6-2-4-8-15(13)17(10-11-18)16-9-5-3-7-14(12)16/h2-9H,10-11H2,1H3
InChIKeyNXXVFAYPAVDIEM-UHFFFAOYSA-N
MW238.31 g/mol
LogP4.81
Rot. Bonds2

About 9-(2-fluoroethyl)-10-methylanthracene

9-(2-fluoroethyl)-10-methylanthracene (PubChem CID 13283739) has the molecular formula C17H15F and a molecular weight of 238.31 g/mol. Its IUPAC name is 9-(2-fluoroethyl)-10-methylanthracene.

Molecular Properties

Compound Name9-(2-fluoroethyl)-10-methylanthracene
PubChem CID13283739
Molecular FormulaC17H15F
Molecular Weight238.31 g/mol
Exact Mass238.12
IUPAC Name9-(2-fluoroethyl)-10-methylanthracene
SMILESCc1c2ccccc2c(CCF)c2ccccc12
InChIInChI=1S/C17H15F/c1-12-13-6-2-4-8-15(13)17(10-11-18)16-9-5-3-7-14(12)16/h2-9H,10-11H2,1H3
InChIKeyNXXVFAYPAVDIEM-UHFFFAOYSA-N
XLogP4.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 54.81
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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Frequently Asked Questions

What is the IUPAC name of 9-(2-fluoroethyl)-10-methylanthracene?
The IUPAC name of 9-(2-fluoroethyl)-10-methylanthracene (CID 13283739) is 9-(2-fluoroethyl)-10-methylanthracene.
What is the SMILES notation for 9-(2-fluoroethyl)-10-methylanthracene?
The canonical SMILES for 9-(2-fluoroethyl)-10-methylanthracene is Cc1c2ccccc2c(CCF)c2ccccc12.
What is the InChIKey of 9-(2-fluoroethyl)-10-methylanthracene?
The InChIKey is NXXVFAYPAVDIEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F/c1-12-13-6-2-4-8-15(13)17(10-11-18)16-9-5-3-7-14(12)16/h2-9H,10-11H2,1H3.
What are the key properties of 9-(2-fluoroethyl)-10-methylanthracene?
9-(2-fluoroethyl)-10-methylanthracene has a molecular weight of 238.31 g/mol, XLogP of 4.81, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-fluoroethyl)-10-methylanthracene is sourced from PubChem (CID 13283739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).