(3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol

C8H16O6 — CID 134850656

IUPAC(3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol
SMILESCOCO[C@H]1COC(O)[C@@H]1OCOC
InChIInChI=1S/C8H16O6/c1-10-4-13-6-3-12-8(9)7(6)14-5-11-2/h6-9H,3-5H2,1-2H3/t6-,7+,8?/m0/s1
InChIKeyIXOQCXCVIKWOTG-KJFJCRTCSA-N
MW208.21 g/mol
LogP-0.69
Rot. Bonds6

About (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol

(3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol (PubChem CID 134850656) has the molecular formula C8H16O6 and a molecular weight of 208.21 g/mol. Its IUPAC name is (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol.

Molecular Properties

Compound Name(3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol
PubChem CID134850656
Molecular FormulaC8H16O6
Molecular Weight208.21 g/mol
Exact Mass208.09
IUPAC Name(3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol
SMILESCOCO[C@H]1COC(O)[C@@H]1OCOC
InChIInChI=1S/C8H16O6/c1-10-4-13-6-3-12-8(9)7(6)14-5-11-2/h6-9H,3-5H2,1-2H3/t6-,7+,8?/m0/s1
InChIKeyIXOQCXCVIKWOTG-KJFJCRTCSA-N
XLogP-0.69
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(3R)-3-(methoxymethoxy)oxolan-2-ol
CID 11423676
(3S,6S)-3-methoxy-6-(methoxymethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 118967664
tris(dimethoxymethane);hydron;(3R,6R)-3-methoxy-6-(methoxymethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;(3S,6R)-3-methoxy-6-(methoxymethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan;(3S,6S)-3-methoxy-6-(methoxymethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 159086843
(2R,3R,4S,5S)-3,5-dimethoxyoxane-2,4-diol
CID 14564498
[(3R,3aR,6S,6aR)-3-(methoxymethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] 2-methylprop-2-enoate
CID 89381495
5-methoxyoxane-2,3,4-triol
CID 560177
(2S,3S,4S)-4-(methoxymethoxy)-3-methyloxolane-2,3-diol
CID 130917775
(3R,4S,5R,6S)-6-ethenyl-3,4,5-tris(methoxymethoxy)oxan-2-ol
CID 11185911
S-[(3R,3aR,6S,6aS)-3-(methoxymethoxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ethanethioate;S-[(3R,3aS,6S,6aS)-3-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ethanethioate
CID 158313936
(1R,2S,5R,6R)-5-(methoxymethoxy)-2-phenylmethoxy-3,7-dioxabicyclo[4.1.0]heptane
CID 101477370
(1R,2S,5S,6R)-5-(methoxymethoxy)-2-phenylmethoxy-3,7-dioxabicyclo[4.1.0]heptane
CID 100974809
3-(methoxymethoxy)cyclopentan-1-ol
CID 91618356

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol?
The IUPAC name of (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol (CID 134850656) is (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol.
What is the SMILES notation for (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol?
The canonical SMILES for (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol is COCO[C@H]1COC(O)[C@@H]1OCOC.
What is the InChIKey of (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol?
The InChIKey is IXOQCXCVIKWOTG-KJFJCRTCSA-N. The full InChI is InChI=1S/C8H16O6/c1-10-4-13-6-3-12-8(9)7(6)14-5-11-2/h6-9H,3-5H2,1-2H3/t6-,7+,8?/m0/s1.
What are the key properties of (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol?
(3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol has a molecular weight of 208.21 g/mol, XLogP of -0.69, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-3,4-bis(methoxymethoxy)oxolan-2-ol is sourced from PubChem (CID 134850656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).