(2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol

C8H16O5 — CID 54140471

IUPAC(2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol
SMILESCOC[C@H]1OC[C@H](O)[C@@H](OC)[C@@H]1O
InChIInChI=1S/C8H16O5/c1-11-4-6-7(10)8(12-2)5(9)3-13-6/h5-10H,3-4H2,1-2H3/t5-,6+,7+,8+/m0/s1
InChIKeyDTZZLEUMRFNZGW-LXGUWJNJSA-N
MW192.21 g/mol
LogP-1.23
Rot. Bonds3

About (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol

(2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol (PubChem CID 54140471) has the molecular formula C8H16O5 and a molecular weight of 192.21 g/mol. Its IUPAC name is (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol.

Molecular Properties

Compound Name(2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol
PubChem CID54140471
Molecular FormulaC8H16O5
Molecular Weight192.21 g/mol
Exact Mass192.10
IUPAC Name(2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol
SMILESCOC[C@H]1OC[C@H](O)[C@@H](OC)[C@@H]1O
InChIInChI=1S/C8H16O5/c1-11-4-6-7(10)8(12-2)5(9)3-13-6/h5-10H,3-4H2,1-2H3/t5-,6+,7+,8+/m0/s1
InChIKeyDTZZLEUMRFNZGW-LXGUWJNJSA-N
XLogP-1.23
TPSA68.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 5-1.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S,4R,5R)-2-(methoxymethyl)oxane-3,4,5-triol
CID 54109760
(2R,3R,4S,5S)-4,5-dimethoxy-2-(methoxymethyl)oxan-3-ol
CID 10943643
2-(hydroxymethyl)-4-methoxyoxane-3,5-diol
CID 19699733
(2R,3R,4R,5S)-2-(hydroxymethyl)-4-methoxyoxane-3,5-diol
CID 18645218
(3R,4R,5S,6S)-6-(hydroxymethyl)-4,5-dimethoxyoxan-3-ol
CID 100993548
(2R,3S,4R,5S)-4-methoxy-2-methyloxane-3,5-diol
CID 130831748
(2S,3R,4S,5R)-2,4-dimethoxyoxane-3,5-diol
CID 100984386
(2R,5S)-2-[(3S,5S)-5-hydroxy-2-(hydroxymethyl)-4-methyloxan-3-yl]oxy-4-methoxy-6-(methoxymethyl)oxane-3,5-diol
CID 163470872
(3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane
CID 122461193
3-methoxy-6-(methoxymethyl)oxane-2,4,5-triol
CID 6421426
(2S,3S,4S,5S)-3,4,5-trimethoxy-2-(methoxymethyl)oxane
CID 122576492
(2R,3S,4S,5R,6S)-5-methoxy-6-(methoxymethyl)oxane-2,3,4-triol
CID 125028190

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol?
The IUPAC name of (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol (CID 54140471) is (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol.
What is the SMILES notation for (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol?
The canonical SMILES for (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol is COC[C@H]1OC[C@H](O)[C@@H](OC)[C@@H]1O.
What is the InChIKey of (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol?
The InChIKey is DTZZLEUMRFNZGW-LXGUWJNJSA-N. The full InChI is InChI=1S/C8H16O5/c1-11-4-6-7(10)8(12-2)5(9)3-13-6/h5-10H,3-4H2,1-2H3/t5-,6+,7+,8+/m0/s1.
What are the key properties of (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol?
(2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol has a molecular weight of 192.21 g/mol, XLogP of -1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol is sourced from PubChem (CID 54140471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).