(3R,5R)-3,4,5-trimethoxyoxane

C8H16O4 — CID 6428184

IUPAC(3R,5R)-3,4,5-trimethoxyoxane
SMILESCOC1[C@H](OC)COC[C@H]1OC
InChIInChI=1S/C8H16O4/c1-9-6-4-12-5-7(10-2)8(6)11-3/h6-8H,4-5H2,1-3H3/t6-,7-/m1/s1
InChIKeyDKQVTQIPWUFZRF-RNFRBKRXSA-N
MW176.21 g/mol
LogP0.06
Rot. Bonds3

About (3R,5R)-3,4,5-trimethoxyoxane

(3R,5R)-3,4,5-trimethoxyoxane (PubChem CID 6428184) has the molecular formula C8H16O4 and a molecular weight of 176.21 g/mol. Its IUPAC name is (3R,5R)-3,4,5-trimethoxyoxane.

Molecular Properties

Compound Name(3R,5R)-3,4,5-trimethoxyoxane
PubChem CID6428184
Molecular FormulaC8H16O4
Molecular Weight176.21 g/mol
Exact Mass176.10
IUPAC Name(3R,5R)-3,4,5-trimethoxyoxane
SMILESCOC1[C@H](OC)COC[C@H]1OC
InChIInChI=1S/C8H16O4/c1-9-6-4-12-5-7(10-2)8(6)11-3/h6-8H,4-5H2,1-3H3/t6-,7-/m1/s1
InChIKeyDKQVTQIPWUFZRF-RNFRBKRXSA-N
XLogP0.06
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-3-methoxy-4-methyloxolane
CID 147902074
[(3S,5S)-5-acetyloxy-4-methoxyoxan-3-yl] acetate
CID 100966636
[(3R,4S,5S)-4-acetyloxy-5-methoxyoxan-3-yl] acetate
CID 6428305
(3R,4R)-3-(1-iodoethenyl)-4-methoxyoxolane
CID 12039541
4-methoxyoxolane-3-sulfonyl fluoride
CID 130973853
(3S,4R)-4-methoxyoxolane-3-sulfonamide
CID 132992802
N'-(4-methoxyoxolan-3-yl)-N'-methylmethanediamine
CID 177342052
ethane;3-methoxy-4-methyloxane
CID 143656491
4-chloro-3-methoxyoxane
CID 130632423
(3S,3aR,6aS)-3-methoxy-2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan
CID 90140604
(2S,3R,4R)-3,4-dimethoxyoxolane-2-carbaldehyde
CID 154729224
[(2S,3R,4S)-3,4-dimethoxyoxolan-2-yl]methanol
CID 131019515

Frequently Asked Questions

What is the IUPAC name of (3R,5R)-3,4,5-trimethoxyoxane?
The IUPAC name of (3R,5R)-3,4,5-trimethoxyoxane (CID 6428184) is (3R,5R)-3,4,5-trimethoxyoxane.
What is the SMILES notation for (3R,5R)-3,4,5-trimethoxyoxane?
The canonical SMILES for (3R,5R)-3,4,5-trimethoxyoxane is COC1[C@H](OC)COC[C@H]1OC.
What is the InChIKey of (3R,5R)-3,4,5-trimethoxyoxane?
The InChIKey is DKQVTQIPWUFZRF-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H16O4/c1-9-6-4-12-5-7(10-2)8(6)11-3/h6-8H,4-5H2,1-3H3/t6-,7-/m1/s1.
What are the key properties of (3R,5R)-3,4,5-trimethoxyoxane?
(3R,5R)-3,4,5-trimethoxyoxane has a molecular weight of 176.21 g/mol, XLogP of 0.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5R)-3,4,5-trimethoxyoxane is sourced from PubChem (CID 6428184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).