(2R)-4-ethyl-2-hydroxy-2H-furan-5-one

C6H8O3 — CID 124583750

IUPAC(2R)-4-ethyl-2-hydroxy-2H-furan-5-one
SMILESCCC1=C[C@H](O)OC1=O
InChIInChI=1S/C6H8O3/c1-2-4-3-5(7)9-6(4)8/h3,5,7H,2H2,1H3/t5-/m1/s1
InChIKeyQCBSIVCQQPAZMF-RXMQYKEDSA-N
MW128.13 g/mol
LogP0.20
Rot. Bonds1

About (2R)-4-ethyl-2-hydroxy-2H-furan-5-one

(2R)-4-ethyl-2-hydroxy-2H-furan-5-one (PubChem CID 124583750) has the molecular formula C6H8O3 and a molecular weight of 128.13 g/mol. Its IUPAC name is (2R)-4-ethyl-2-hydroxy-2H-furan-5-one.

Molecular Properties

Compound Name(2R)-4-ethyl-2-hydroxy-2H-furan-5-one
PubChem CID124583750
Molecular FormulaC6H8O3
Molecular Weight128.13 g/mol
Exact Mass128.05
IUPAC Name(2R)-4-ethyl-2-hydroxy-2H-furan-5-one
SMILESCCC1=C[C@H](O)OC1=O
InChIInChI=1S/C6H8O3/c1-2-4-3-5(7)9-6(4)8/h3,5,7H,2H2,1H3/t5-/m1/s1
InChIKeyQCBSIVCQQPAZMF-RXMQYKEDSA-N
XLogP0.20
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-4-methyl-2H-furan-5-one
CID 5279300
2-hydroxy-4-(4-oxoundecyl)-2H-furan-5-one
CID 19433155
(2R)-4-(4,8-dimethylnona-3,7-dienyl)-2-hydroxy-2H-furan-5-one
CID 162932378
(4S)-2-ethyl-4-hydroxycyclopent-2-en-1-one
CID 58922282
(3aS,7aR)-6-ethyl-3,3a,4,7a-tetrahydro-1H-2-benzofuran-5-one
CID 101347440
(2R,6E,10E)-13-(2-hydroxy-5-oxo-2H-furan-4-yl)-2,6,10-trimethyltrideca-6,10-dienoic acid
CID 163107949
(2S)-2-methyl-4-[14-[(2R)-2-methyl-5-oxo-2H-furan-4-yl]tetradecyl]-2H-furan-5-one
CID 101036422
(2R)-4-heptyl-2-methyl-2H-furan-5-one
CID 10774282
(2R)-2-[(1R)-1-hydroxyethyl]-4-[(2R)-2-hydroxypropyl]-2H-furan-5-one
CID 38351285
(2S)-4-hexadecyl-2-methyl-2H-furan-5-one
CID 14188599
4-(2-aminotetradecan-2-yl)-2-hydroxy-2H-furan-5-one;N-methylmethanamine
CID 67938981
(2R)-4-[2-[(1S,8aS)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2-hydroxy-2H-furan-5-one
CID 102413421

Frequently Asked Questions

What is the IUPAC name of (2R)-4-ethyl-2-hydroxy-2H-furan-5-one?
The IUPAC name of (2R)-4-ethyl-2-hydroxy-2H-furan-5-one (CID 124583750) is (2R)-4-ethyl-2-hydroxy-2H-furan-5-one.
What is the SMILES notation for (2R)-4-ethyl-2-hydroxy-2H-furan-5-one?
The canonical SMILES for (2R)-4-ethyl-2-hydroxy-2H-furan-5-one is CCC1=C[C@H](O)OC1=O.
What is the InChIKey of (2R)-4-ethyl-2-hydroxy-2H-furan-5-one?
The InChIKey is QCBSIVCQQPAZMF-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H8O3/c1-2-4-3-5(7)9-6(4)8/h3,5,7H,2H2,1H3/t5-/m1/s1.
What are the key properties of (2R)-4-ethyl-2-hydroxy-2H-furan-5-one?
(2R)-4-ethyl-2-hydroxy-2H-furan-5-one has a molecular weight of 128.13 g/mol, XLogP of 0.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-ethyl-2-hydroxy-2H-furan-5-one is sourced from PubChem (CID 124583750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).