(2Z)-2-(hydroxymethylidene)oxolane-3,4-diol

C5H8O4 — CID 134692637

IUPAC(2Z)-2-(hydroxymethylidene)oxolane-3,4-diol
SMILESO/C=C1\OCC(O)C1O
InChIInChI=1S/C5H8O4/c6-1-4-5(8)3(7)2-9-4/h1,3,5-8H,2H2/b4-1-
InChIKeyVYESUJXOGPEHNK-RJRFIUFISA-N
MW132.11 g/mol
LogP-0.86
Rot. Bonds

About (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol

(2Z)-2-(hydroxymethylidene)oxolane-3,4-diol (PubChem CID 134692637) has the molecular formula C5H8O4 and a molecular weight of 132.11 g/mol. Its IUPAC name is (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol.

Molecular Properties

Compound Name(2Z)-2-(hydroxymethylidene)oxolane-3,4-diol
PubChem CID134692637
Molecular FormulaC5H8O4
Molecular Weight132.11 g/mol
Exact Mass132.04
IUPAC Name(2Z)-2-(hydroxymethylidene)oxolane-3,4-diol
SMILESO/C=C1\OCC(O)C1O
InChIInChI=1S/C5H8O4/c6-1-4-5(8)3(7)2-9-4/h1,3,5-8H,2H2/b4-1-
InChIKeyVYESUJXOGPEHNK-RJRFIUFISA-N
XLogP-0.86
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.11
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

Ribal
CID 126055
2,5-Anhydro-4-deoxy-D-erythro-pent-4-enitol
CID 49867562
(2R,3S,4S)-2-(hydroxymethyl)-5-(hydroxymethylidene)oxolane-3,4-diol
CID 56947165
1,4-anhydro-D-erythro-pent-1-enitol
CID 49867561
(2E,3S,4R,5S)-2-(fluoromethylidene)-5-methyloxolane-3,4-diol
CID 134853658
(2Z,3S,4R,5S)-2-(fluoromethylidene)-5-methyloxolane-3,4-diol
CID 134969754
(2S,3R,4S)-2-methyl-5-methylideneoxolane-3,4-diol
CID 60105624
4-Fluoro-2-(hydroxymethyl)-2,3-dihydrofuran-3-ol
CID 89008544
(5E)-5-(hydroxymethylidene)oxolane-2,3,4-triol
CID 17915153
CID 57893345
CID 57893345
(2S,4S)-2-methyl-5-methylideneoxolane-3,4-diol
CID 57893360
(3S,4S)-5-methylidene-3,4-dihydro-2H-furan-2-ide-3,4-diol;uranium
CID 58602404

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol?
The IUPAC name of (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol (CID 134692637) is (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol.
What is the SMILES notation for (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol?
The canonical SMILES for (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol is O/C=C1\OCC(O)C1O.
What is the InChIKey of (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol?
The InChIKey is VYESUJXOGPEHNK-RJRFIUFISA-N. The full InChI is InChI=1S/C5H8O4/c6-1-4-5(8)3(7)2-9-4/h1,3,5-8H,2H2/b4-1-.
What are the key properties of (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol?
(2Z)-2-(hydroxymethylidene)oxolane-3,4-diol has a molecular weight of 132.11 g/mol, XLogP of -0.86, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(hydroxymethylidene)oxolane-3,4-diol is sourced from PubChem (CID 134692637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).