(2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol

C7H12O4 — CID 13149086

IUPAC(2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol
SMILESCOCOC[C@H]1OC=C[C@@H]1O
InChIInChI=1S/C7H12O4/c1-9-5-10-4-7-6(8)2-3-11-7/h2-3,6-8H,4-5H2,1H3/t6-,7+/m0/s1
InChIKeyWQCRGGUKEFTOEW-NKWVEPMBSA-N
MW160.17 g/mol
LogP-0.12
Rot. Bonds4

About (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol

(2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol (PubChem CID 13149086) has the molecular formula C7H12O4 and a molecular weight of 160.17 g/mol. Its IUPAC name is (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol.

Molecular Properties

Compound Name(2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol
PubChem CID13149086
Molecular FormulaC7H12O4
Molecular Weight160.17 g/mol
Exact Mass160.07
IUPAC Name(2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol
SMILESCOCOC[C@H]1OC=C[C@@H]1O
InChIInChI=1S/C7H12O4/c1-9-5-10-4-7-6(8)2-3-11-7/h2-3,6-8H,4-5H2,1H3/t6-,7+/m0/s1
InChIKeyWQCRGGUKEFTOEW-NKWVEPMBSA-N
XLogP-0.12
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.17
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol?
The IUPAC name of (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol (CID 13149086) is (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol.
What is the SMILES notation for (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol?
The canonical SMILES for (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol is COCOC[C@H]1OC=C[C@@H]1O.
What is the InChIKey of (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol?
The InChIKey is WQCRGGUKEFTOEW-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H12O4/c1-9-5-10-4-7-6(8)2-3-11-7/h2-3,6-8H,4-5H2,1H3/t6-,7+/m0/s1.
What are the key properties of (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol?
(2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol has a molecular weight of 160.17 g/mol, XLogP of -0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-(methoxymethoxymethyl)-2,3-dihydrofuran-3-ol is sourced from PubChem (CID 13149086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).