(3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane

C10H20O5 — CID 122461193

IUPAC(3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane
SMILESCOCC1OCC(OC)C(OC)[C@@H]1OC
InChIInChI=1S/C10H20O5/c1-11-5-8-10(14-4)9(13-3)7(12-2)6-15-8/h7-10H,5-6H2,1-4H3/t7?,8?,9?,10-/m1/s1
InChIKeySQOPNOVHKFZFPJ-SYZWKDNESA-N
MW220.26 g/mol
LogP0.08
Rot. Bonds5

About (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane

(3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane (PubChem CID 122461193) has the molecular formula C10H20O5 and a molecular weight of 220.26 g/mol. Its IUPAC name is (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane.

Molecular Properties

Compound Name(3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane
PubChem CID122461193
Molecular FormulaC10H20O5
Molecular Weight220.26 g/mol
Exact Mass220.13
IUPAC Name(3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane
SMILESCOCC1OCC(OC)C(OC)[C@@H]1OC
InChIInChI=1S/C10H20O5/c1-11-5-8-10(14-4)9(13-3)7(12-2)6-15-8/h7-10H,5-6H2,1-4H3/t7?,8?,9?,10-/m1/s1
InChIKeySQOPNOVHKFZFPJ-SYZWKDNESA-N
XLogP0.08
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.26
LogP ≤ 50.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S,3S,4S,5S)-3,4,5-trimethoxy-2-(methoxymethyl)oxane
CID 122576492
(2R,3R,4S,5S)-4,5-dimethoxy-2-(methoxymethyl)oxan-3-ol
CID 10943643
(4-acetyloxy-3,5-dimethoxyoxan-2-yl)methyl acetate
CID 526606
[(2S,3R,4S)-3,4-dimethoxyoxolan-2-yl]methanol
CID 131019515
[(2S,3R,4R,5R)-5-acetyloxy-3,4-dimethoxyoxan-2-yl]methyl acetate
CID 91747030
[(2R,3R,4R,5S)-3,4-diacetyloxy-5-methoxyoxan-2-yl]methyl acetate
CID 6428063
[4-acetyloxy-5-(methoxymethyl)oxolan-3-yl] acetate
CID 526631
(2R,3R,4R,5S)-4-methoxy-2-(methoxymethyl)oxane-3,5-diol
CID 54140471
[(2R,3R,4R,5S)-4,5-dimethoxy-2-(propoxymethyl)oxan-3-yl] acetate
CID 16745162
[(3S,4R,5R,6R)-4,5-diacetyloxy-6-(methoxymethyl)oxan-3-yl] acetate
CID 6428058
(2R,3S)-3-methoxy-4-propan-2-yloxy-2-(propan-2-yloxymethyl)oxolane
CID 177259803
(2R)-3-methoxy-2-(methoxymethyl)oxane
CID 169023835

Frequently Asked Questions

What is the IUPAC name of (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane?
The IUPAC name of (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane (CID 122461193) is (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane.
What is the SMILES notation for (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane?
The canonical SMILES for (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane is COCC1OCC(OC)C(OC)[C@@H]1OC.
What is the InChIKey of (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane?
The InChIKey is SQOPNOVHKFZFPJ-SYZWKDNESA-N. The full InChI is InChI=1S/C10H20O5/c1-11-5-8-10(14-4)9(13-3)7(12-2)6-15-8/h7-10H,5-6H2,1-4H3/t7?,8?,9?,10-/m1/s1.
What are the key properties of (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane?
(3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane has a molecular weight of 220.26 g/mol, XLogP of 0.08, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3,4,5-trimethoxy-2-(methoxymethyl)oxane is sourced from PubChem (CID 122461193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).