2-(fluoromethyl)anthracene

C15H11F — CID 175235135

IUPAC2-(fluoromethyl)anthracene
SMILESFCc1ccc2cc3ccccc3cc2c1
InChIInChI=1S/C15H11F/c16-10-11-5-6-14-8-12-3-1-2-4-13(12)9-15(14)7-11/h1-9H,10H2
InChIKeyPUBDWDCCZXVZCM-UHFFFAOYSA-N
MW210.25 g/mol
LogP4.46
Rot. Bonds1

About 2-(fluoromethyl)anthracene

2-(fluoromethyl)anthracene (PubChem CID 175235135) has the molecular formula C15H11F and a molecular weight of 210.25 g/mol. Its IUPAC name is 2-(fluoromethyl)anthracene.

Molecular Properties

Compound Name2-(fluoromethyl)anthracene
PubChem CID175235135
Molecular FormulaC15H11F
Molecular Weight210.25 g/mol
Exact Mass210.08
IUPAC Name2-(fluoromethyl)anthracene
SMILESFCc1ccc2cc3ccccc3cc2c1
InChIInChI=1S/C15H11F/c16-10-11-5-6-14-8-12-3-1-2-4-13(12)9-15(14)7-11/h1-9H,10H2
InChIKeyPUBDWDCCZXVZCM-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 54.46
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

pentacen-2-ylmethanethiol
CID 59381280
pentacen-2-ylmethanamine
CID 162482734
dodecacyclo[24.24.0.03,24.05,22.07,20.09,18.011,16.028,49.030,47.032,45.034,43.036,41]pentaconta-1(50),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48-pentacosaene
CID 54171203
2-(naphthalen-2-ylmethyl)naphthalene
CID 14123480
1-anthracen-2-ylbutan-2-ol
CID 141488114
2-butyltetracene
CID 177478805
2-butylpentacene
CID 172754039
gold;pentacene
CID 162013118
2-octylanthracene
CID 23131226
ethane;2-ethylnaphthalene
CID 90684887
2-benzylnaphthalene
CID 11948
2-(11-naphthalen-2-ylundecyl)naphthalene
CID 86035863

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)anthracene?
The IUPAC name of 2-(fluoromethyl)anthracene (CID 175235135) is 2-(fluoromethyl)anthracene.
What is the SMILES notation for 2-(fluoromethyl)anthracene?
The canonical SMILES for 2-(fluoromethyl)anthracene is FCc1ccc2cc3ccccc3cc2c1.
What is the InChIKey of 2-(fluoromethyl)anthracene?
The InChIKey is PUBDWDCCZXVZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F/c16-10-11-5-6-14-8-12-3-1-2-4-13(12)9-15(14)7-11/h1-9H,10H2.
What are the key properties of 2-(fluoromethyl)anthracene?
2-(fluoromethyl)anthracene has a molecular weight of 210.25 g/mol, XLogP of 4.46, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)anthracene is sourced from PubChem (CID 175235135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).