8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran

C19H17FO2 — CID 7919332

IUPAC8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran
SMILESFc1ccccc1COc1ccc2oc3c(c2c1)CCCC3
InChIInChI=1S/C19H17FO2/c20-17-7-3-1-5-13(17)12-21-14-9-10-19-16(11-14)15-6-2-4-8-18(15)22-19/h1,3,5,7,9-11H,2,4,6,8,12H2
InChIKeyMCYBRHVLCPFAPX-UHFFFAOYSA-N
MW296.34 g/mol
LogP5.03
Rot. Bonds3

About 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran

8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran (PubChem CID 7919332) has the molecular formula C19H17FO2 and a molecular weight of 296.34 g/mol. Its IUPAC name is 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran.

Molecular Properties

Compound Name8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran
PubChem CID7919332
Molecular FormulaC19H17FO2
Molecular Weight296.34 g/mol
Exact Mass296.12
IUPAC Name8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran
SMILESFc1ccccc1COc1ccc2oc3c(c2c1)CCCC3
InChIInChI=1S/C19H17FO2/c20-17-7-3-1-5-13(17)12-21-14-9-10-19-16(11-14)15-6-2-4-8-18(15)22-19/h1,3,5,7,9-11H,2,4,6,8,12H2
InChIKeyMCYBRHVLCPFAPX-UHFFFAOYSA-N
XLogP5.03
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.34
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran?
The IUPAC name of 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran (CID 7919332) is 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran.
What is the SMILES notation for 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran?
The canonical SMILES for 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran is Fc1ccccc1COc1ccc2oc3c(c2c1)CCCC3.
What is the InChIKey of 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran?
The InChIKey is MCYBRHVLCPFAPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FO2/c20-17-7-3-1-5-13(17)12-21-14-9-10-19-16(11-14)15-6-2-4-8-18(15)22-19/h1,3,5,7,9-11H,2,4,6,8,12H2.
What are the key properties of 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran?
8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran has a molecular weight of 296.34 g/mol, XLogP of 5.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2-fluorophenyl)methoxy]-1,2,3,4-tetrahydrodibenzofuran is sourced from PubChem (CID 7919332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).