(3R)-2,3,5-trimethoxyoxane

C8H16O4 — CID 145057673

IUPAC(3R)-2,3,5-trimethoxyoxane
SMILESCOC1COC(OC)[C@H](OC)C1
InChIInChI=1S/C8H16O4/c1-9-6-4-7(10-2)8(11-3)12-5-6/h6-8H,4-5H2,1-3H3/t6?,7-,8?/m1/s1
InChIKeyUPXNBEBFMXDZDV-ZUEIMRROSA-N
MW176.21 g/mol
LogP0.41
Rot. Bonds3

About (3R)-2,3,5-trimethoxyoxane

(3R)-2,3,5-trimethoxyoxane (PubChem CID 145057673) has the molecular formula C8H16O4 and a molecular weight of 176.21 g/mol. Its IUPAC name is (3R)-2,3,5-trimethoxyoxane.

Molecular Properties

Compound Name(3R)-2,3,5-trimethoxyoxane
PubChem CID145057673
Molecular FormulaC8H16O4
Molecular Weight176.21 g/mol
Exact Mass176.10
IUPAC Name(3R)-2,3,5-trimethoxyoxane
SMILESCOC1COC(OC)[C@H](OC)C1
InChIInChI=1S/C8H16O4/c1-9-6-4-7(10-2)8(11-3)12-5-6/h6-8H,4-5H2,1-3H3/t6?,7-,8?/m1/s1
InChIKeyUPXNBEBFMXDZDV-ZUEIMRROSA-N
XLogP0.41
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 ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,3S,4S,5S,6R)-2,6-dimethoxyoxepane-3,4,5-triol
CID 58510378
1,4-dimethoxy-2-methylcyclopentane
CID 170203002
(1S,2S,5R)-2-methoxy-3-oxabicyclo[3.1.0]hexane
CID 142869266
2,3,4-trimethoxy-5-[(2R,3S,4S,5R)-3,4,5-trimethoxyoxan-2-yl]oxyoxane
CID 91699165
(2R,3R,5R,6S)-2,3,5-trimethoxy-6-methyloxane
CID 88978646
1,2,4-trimethoxycyclohexane
CID 547386
(3S,3aR,6S,6aR)-3,6-dimethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;(3S,3aR,6R,6aR)-3,6-dimethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;(3R,3aR,6R,6aR)-3,6-dimethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;3,6-dimethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 159029439
(3R,3aR,6R,6aS)-3,6-dimethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 7168228
(3S,3aS,6R,6aR)-3,6-dimethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 13002871
1,3,5-trimethoxycyclohexane
CID 547415
(2R,3R,4S)-2-methoxyoxolane-3,4-diol
CID 14443636
(2R,3S,4S)-2-methoxyoxolane-3,4-diol
CID 130831872

Frequently Asked Questions

What is the IUPAC name of (3R)-2,3,5-trimethoxyoxane?
The IUPAC name of (3R)-2,3,5-trimethoxyoxane (CID 145057673) is (3R)-2,3,5-trimethoxyoxane.
What is the SMILES notation for (3R)-2,3,5-trimethoxyoxane?
The canonical SMILES for (3R)-2,3,5-trimethoxyoxane is COC1COC(OC)[C@H](OC)C1.
What is the InChIKey of (3R)-2,3,5-trimethoxyoxane?
The InChIKey is UPXNBEBFMXDZDV-ZUEIMRROSA-N. The full InChI is InChI=1S/C8H16O4/c1-9-6-4-7(10-2)8(11-3)12-5-6/h6-8H,4-5H2,1-3H3/t6?,7-,8?/m1/s1.
What are the key properties of (3R)-2,3,5-trimethoxyoxane?
(3R)-2,3,5-trimethoxyoxane has a molecular weight of 176.21 g/mol, XLogP of 0.41, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2,3,5-trimethoxyoxane is sourced from PubChem (CID 145057673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).