(2R,3R,4R)-2-methoxyoxane-3,4-diol

C6H12O4 — CID 101075515

IUPAC(2R,3R,4R)-2-methoxyoxane-3,4-diol
SMILESCO[C@@H]1OCC[C@@H](O)[C@H]1O
InChIInChI=1S/C6H12O4/c1-9-6-5(8)4(7)2-3-10-6/h4-8H,2-3H2,1H3/t4-,5-,6-/m1/s1
InChIKeyQVNPTEPOWBEITR-HSUXUTPPSA-N
MW148.16 g/mol
LogP-0.90
Rot. Bonds1

About (2R,3R,4R)-2-methoxyoxane-3,4-diol

(2R,3R,4R)-2-methoxyoxane-3,4-diol (PubChem CID 101075515) has the molecular formula C6H12O4 and a molecular weight of 148.16 g/mol. Its IUPAC name is (2R,3R,4R)-2-methoxyoxane-3,4-diol.

Molecular Properties

Compound Name(2R,3R,4R)-2-methoxyoxane-3,4-diol
PubChem CID101075515
Molecular FormulaC6H12O4
Molecular Weight148.16 g/mol
Exact Mass148.07
IUPAC Name(2R,3R,4R)-2-methoxyoxane-3,4-diol
SMILESCO[C@@H]1OCC[C@@H](O)[C@H]1O
InChIInChI=1S/C6H12O4/c1-9-6-5(8)4(7)2-3-10-6/h4-8H,2-3H2,1H3/t4-,5-,6-/m1/s1
InChIKeyQVNPTEPOWBEITR-HSUXUTPPSA-N
XLogP-0.90
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,3R,4R)-2-methoxyoxane-3,4-diol
CID 130918320
(2R,3S,4S)-2-methoxyoxolane-3,4-diol
CID 130831872
(2R,3R,4S)-2-methoxyoxolane-3,4-diol
CID 14443636
(2R,3S,4R)-3-amino-2-methoxyoxan-4-ol
CID 55289399
(2S,4R,5R)-2-methoxyoxane-3,4,5-triol
CID 24802344
2-propan-2-yloxane-3,4-diol
CID 70217654
(2S,3R,4S,5R)-2,4-dimethoxyoxane-3,5-diol
CID 100984386
(1S,4aS,6S,7R,7aS)-1-methoxy-7-methyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyran-6-ol
CID 71523916
(4R,5R)-5-methoxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 130240888
(3R)-2-methoxyoxolan-3-amine
CID 121422095
[(2R,3R)-2-methoxyoxolan-3-yl]methanol
CID 130877552
(2S,3S)-2-methoxyoxolane-3-carboxylic acid
CID 97303923

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R)-2-methoxyoxane-3,4-diol?
The IUPAC name of (2R,3R,4R)-2-methoxyoxane-3,4-diol (CID 101075515) is (2R,3R,4R)-2-methoxyoxane-3,4-diol.
What is the SMILES notation for (2R,3R,4R)-2-methoxyoxane-3,4-diol?
The canonical SMILES for (2R,3R,4R)-2-methoxyoxane-3,4-diol is CO[C@@H]1OCC[C@@H](O)[C@H]1O.
What is the InChIKey of (2R,3R,4R)-2-methoxyoxane-3,4-diol?
The InChIKey is QVNPTEPOWBEITR-HSUXUTPPSA-N. The full InChI is InChI=1S/C6H12O4/c1-9-6-5(8)4(7)2-3-10-6/h4-8H,2-3H2,1H3/t4-,5-,6-/m1/s1.
What are the key properties of (2R,3R,4R)-2-methoxyoxane-3,4-diol?
(2R,3R,4R)-2-methoxyoxane-3,4-diol has a molecular weight of 148.16 g/mol, XLogP of -0.90, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R)-2-methoxyoxane-3,4-diol is sourced from PubChem (CID 101075515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).