5-methyl-6-phenyl-2,3-dihydro-1-benzofuran

C15H14O — CID 12878338

IUPAC5-methyl-6-phenyl-2,3-dihydro-1-benzofuran
SMILESCc1cc2c(cc1-c1ccccc1)OCC2
InChIInChI=1S/C15H14O/c1-11-9-13-7-8-16-15(13)10-14(11)12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3
InChIKeyFJNMWNNSLOQQPZ-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.60
Rot. Bonds1

About 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran

5-methyl-6-phenyl-2,3-dihydro-1-benzofuran (PubChem CID 12878338) has the molecular formula C15H14O and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name5-methyl-6-phenyl-2,3-dihydro-1-benzofuran
PubChem CID12878338
Molecular FormulaC15H14O
Molecular Weight210.28 g/mol
Exact Mass210.10
IUPAC Name5-methyl-6-phenyl-2,3-dihydro-1-benzofuran
SMILESCc1cc2c(cc1-c1ccccc1)OCC2
InChIInChI=1S/C15H14O/c1-11-9-13-7-8-16-15(13)10-14(11)12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3
InChIKeyFJNMWNNSLOQQPZ-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 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran?
The IUPAC name of 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran (CID 12878338) is 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran?
The canonical SMILES for 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran is Cc1cc2c(cc1-c1ccccc1)OCC2.
What is the InChIKey of 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran?
The InChIKey is FJNMWNNSLOQQPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O/c1-11-9-13-7-8-16-15(13)10-14(11)12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3.
What are the key properties of 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran?
5-methyl-6-phenyl-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 5-methyl-6-phenyl-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 12878338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).