7-(4-methylphenyl)-2,3-dihydro-1-benzofuran

C15H14O — CID 23543625

IUPAC7-(4-methylphenyl)-2,3-dihydro-1-benzofuran
SMILESCc1ccc(-c2cccc3c2OCC3)cc1
InChIInChI=1S/C15H14O/c1-11-5-7-12(8-6-11)14-4-2-3-13-9-10-16-15(13)14/h2-8H,9-10H2,1H3
InChIKeyBYUCJOBOMHXITG-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.60
Rot. Bonds1

About 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran

7-(4-methylphenyl)-2,3-dihydro-1-benzofuran (PubChem CID 23543625) has the molecular formula C15H14O and a molecular weight of 210.28 g/mol. Its IUPAC name is 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name7-(4-methylphenyl)-2,3-dihydro-1-benzofuran
PubChem CID23543625
Molecular FormulaC15H14O
Molecular Weight210.28 g/mol
Exact Mass210.10
IUPAC Name7-(4-methylphenyl)-2,3-dihydro-1-benzofuran
SMILESCc1ccc(-c2cccc3c2OCC3)cc1
InChIInChI=1S/C15H14O/c1-11-5-7-12(8-6-11)14-4-2-3-13-9-10-16-15(13)14/h2-8H,9-10H2,1H3
InChIKeyBYUCJOBOMHXITG-UHFFFAOYSA-N
XLogP3.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran?
The IUPAC name of 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran (CID 23543625) is 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran?
The canonical SMILES for 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran is Cc1ccc(-c2cccc3c2OCC3)cc1.
What is the InChIKey of 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran?
The InChIKey is BYUCJOBOMHXITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O/c1-11-5-7-12(8-6-11)14-4-2-3-13-9-10-16-15(13)14/h2-8H,9-10H2,1H3.
What are the key properties of 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran?
7-(4-methylphenyl)-2,3-dihydro-1-benzofuran has a molecular weight of 210.28 g/mol, XLogP of 3.60, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methylphenyl)-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 23543625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).