(1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol

C8H14O4 — CID 2733897

IUPAC(1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol
SMILESCOC1C=CC(OC)([C@@H](C)O)O1
InChIInChI=1S/C8H14O4/c1-6(9)8(11-3)5-4-7(10-2)12-8/h4-7,9H,1-3H3/t6-,7?,8?/m1/s1
InChIKeyOHXZDCYIALCSNL-JECWYVHBSA-N
MW174.20 g/mol
LogP0.27
Rot. Bonds3

About (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol

(1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol (PubChem CID 2733897) has the molecular formula C8H14O4 and a molecular weight of 174.20 g/mol. Its IUPAC name is (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol.

Molecular Properties

Compound Name(1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol
PubChem CID2733897
Molecular FormulaC8H14O4
Molecular Weight174.20 g/mol
Exact Mass174.09
IUPAC Name(1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol
SMILESCOC1C=CC(OC)([C@@H](C)O)O1
InChIInChI=1S/C8H14O4/c1-6(9)8(11-3)5-4-7(10-2)12-8/h4-7,9H,1-3H3/t6-,7?,8?/m1/s1
InChIKeyOHXZDCYIALCSNL-JECWYVHBSA-N
XLogP0.27
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_misc_A(5)', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

ethyl 2,3-dideoxy-D-hex-2-enopyranoside
CID 97305
(2,5-Dimethoxy-2,5-dihydrofuran-2-yl)methanol
CID 13011793
6-Ethoxy-3,6-dihydro-3-hydroxy-2H-pyran-2-methanol
CID 271273
(2R,3S,6S)-2-(hydroxymethyl)-6-isopentyloxy-3,6-dihydro-2H-pyran-3-ol
CID 54580323
2-(hydroxymethyl)-6-methoxy-3,6-dihydro-2H-pyran-3-ol
CID 360943
2H-Pyran-2-methanol, 3,6-dihydro-3-hydroxy-6-(1-methylethoxy)-
CID 546113
(2S,3S,6R)-6-methoxy-2-methyl-3,6-dihydro-2H-pyran-3-ol
CID 11008031
1-(2,5-Dimethoxy-2,5-dihydrofuran-2-yl)ethanol
CID 2733895
(S)-4,5-isopropylidene-2-pentenol
CID 11008188
5-Hydroxy-2-methoxy-5,6-dihydro-2h-pyran
CID 11400783
[(2R,6R)-6-propan-2-yloxy-3,6-dihydro-2H-pyran-2-yl]methanol
CID 11788550
2-(1-Hydroxyethyl)-2,3,5-trimethoxy-2,5-dihydrofuran
CID 20348360

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol?
The IUPAC name of (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol (CID 2733897) is (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol.
What is the SMILES notation for (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol?
The canonical SMILES for (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol is COC1C=CC(OC)([C@@H](C)O)O1.
What is the InChIKey of (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol?
The InChIKey is OHXZDCYIALCSNL-JECWYVHBSA-N. The full InChI is InChI=1S/C8H14O4/c1-6(9)8(11-3)5-4-7(10-2)12-8/h4-7,9H,1-3H3/t6-,7?,8?/m1/s1.
What are the key properties of (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol?
(1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol has a molecular weight of 174.20 g/mol, XLogP of 0.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2,5-dimethoxy-2H-furan-5-yl)ethanol is sourced from PubChem (CID 2733897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).