(5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one

C11H10O3 — CID 69070002

IUPAC(5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one
SMILESC[C@]1(c2ccccc2)OC(=O)C=C1O
InChIInChI=1S/C11H10O3/c1-11(8-5-3-2-4-6-8)9(12)7-10(13)14-11/h2-7,12H,1H3/t11-/m1/s1
InChIKeyYKQHYEBSWSCZPB-LLVKDONJSA-N
MW190.20 g/mol
LogP1.90
Rot. Bonds1

About (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one

(5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one (PubChem CID 69070002) has the molecular formula C11H10O3 and a molecular weight of 190.20 g/mol. Its IUPAC name is (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one.

Molecular Properties

Compound Name(5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one
PubChem CID69070002
Molecular FormulaC11H10O3
Molecular Weight190.20 g/mol
Exact Mass190.06
IUPAC Name(5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one
SMILESC[C@]1(c2ccccc2)OC(=O)C=C1O
InChIInChI=1S/C11H10O3/c1-11(8-5-3-2-4-6-8)9(12)7-10(13)14-11/h2-7,12H,1H3/t11-/m1/s1
InChIKeyYKQHYEBSWSCZPB-LLVKDONJSA-N
XLogP1.90
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one?
The IUPAC name of (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one (CID 69070002) is (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one.
What is the SMILES notation for (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one?
The canonical SMILES for (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one is C[C@]1(c2ccccc2)OC(=O)C=C1O.
What is the InChIKey of (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one?
The InChIKey is YKQHYEBSWSCZPB-LLVKDONJSA-N. The full InChI is InChI=1S/C11H10O3/c1-11(8-5-3-2-4-6-8)9(12)7-10(13)14-11/h2-7,12H,1H3/t11-/m1/s1.
What are the key properties of (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one?
(5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one has a molecular weight of 190.20 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-4-hydroxy-5-methyl-5-phenylfuran-2-one is sourced from PubChem (CID 69070002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).