(2R)-3-ethoxy-2-phenyl-2H-furan-5-one

C12H12O3 — CID 102003165

IUPAC(2R)-3-ethoxy-2-phenyl-2H-furan-5-one
SMILESCCOC1=CC(=O)O[C@@H]1c1ccccc1
InChIInChI=1S/C12H12O3/c1-2-14-10-8-11(13)15-12(10)9-6-4-3-5-7-9/h3-8,12H,2H2,1H3/t12-/m1/s1
InChIKeyJUFAERRAOKKENJ-GFCCVEGCSA-N
MW204.22 g/mol
LogP2.20
Rot. Bonds3

About (2R)-3-ethoxy-2-phenyl-2H-furan-5-one

(2R)-3-ethoxy-2-phenyl-2H-furan-5-one (PubChem CID 102003165) has the molecular formula C12H12O3 and a molecular weight of 204.22 g/mol. Its IUPAC name is (2R)-3-ethoxy-2-phenyl-2H-furan-5-one.

Molecular Properties

Compound Name(2R)-3-ethoxy-2-phenyl-2H-furan-5-one
PubChem CID102003165
Molecular FormulaC12H12O3
Molecular Weight204.22 g/mol
Exact Mass204.08
IUPAC Name(2R)-3-ethoxy-2-phenyl-2H-furan-5-one
SMILESCCOC1=CC(=O)O[C@@H]1c1ccccc1
InChIInChI=1S/C12H12O3/c1-2-14-10-8-11(13)15-12(10)9-6-4-3-5-7-9/h3-8,12H,2H2,1H3/t12-/m1/s1
InChIKeyJUFAERRAOKKENJ-GFCCVEGCSA-N
XLogP2.20
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.22
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-3-ethoxy-2-phenyl-2H-furan-5-one
CID 102003164
5-oxo-2-phenyl-2H-furan-3-carboxylic acid
CID 70388760
2-phenyl-3-(trifluoromethyl)-2H-furan-5-one
CID 11287612
2-phenyl-3-prop-2-enyl-2H-furan-5-one
CID 102338202
(2R)-3-(benzylamino)-2-phenyl-2H-furan-5-one
CID 25257271
3-ethoxy-1,1-dioxo-2-phenyl-2H-thiopyran-5-one
CID 593960
2-phenyl-3-phenyltellanyl-2H-furan-5-one
CID 134932502
(3R,6S)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432934
(3R,6R)-3,6-diphenyl-1,4-dioxane-2,5-dione
CID 101432935
8-ethyl-2-phenyl-4H-1,4-benzoxazin-3-one
CID 69261563
(4R)-2-ethoxy-5-methyl-4-phenylcyclopent-2-en-1-one
CID 134947311
3-(5-oxo-2-phenyl-4-propyl-2H-furan-3-yl)-2-phenyl-4-propyl-2H-furan-5-one
CID 5250336

Frequently Asked Questions

What is the IUPAC name of (2R)-3-ethoxy-2-phenyl-2H-furan-5-one?
The IUPAC name of (2R)-3-ethoxy-2-phenyl-2H-furan-5-one (CID 102003165) is (2R)-3-ethoxy-2-phenyl-2H-furan-5-one.
What is the SMILES notation for (2R)-3-ethoxy-2-phenyl-2H-furan-5-one?
The canonical SMILES for (2R)-3-ethoxy-2-phenyl-2H-furan-5-one is CCOC1=CC(=O)O[C@@H]1c1ccccc1.
What is the InChIKey of (2R)-3-ethoxy-2-phenyl-2H-furan-5-one?
The InChIKey is JUFAERRAOKKENJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H12O3/c1-2-14-10-8-11(13)15-12(10)9-6-4-3-5-7-9/h3-8,12H,2H2,1H3/t12-/m1/s1.
What are the key properties of (2R)-3-ethoxy-2-phenyl-2H-furan-5-one?
(2R)-3-ethoxy-2-phenyl-2H-furan-5-one has a molecular weight of 204.22 g/mol, XLogP of 2.20, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-ethoxy-2-phenyl-2H-furan-5-one is sourced from PubChem (CID 102003165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).