(1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol

C10H20O6 — CID 135037817

IUPAC(1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol
SMILESCOC1(C)OC[C@H]([C@H](O)CO)O[C@@]1(C)OC
InChIInChI=1S/C10H20O6/c1-9(13-3)10(2,14-4)16-8(6-15-9)7(12)5-11/h7-8,11-12H,5-6H2,1-4H3/t7-,8-,9?,10-/m1/s1
InChIKeyFSNHFIZWYUQRGJ-XKSJUCENSA-N
MW236.26 g/mol
LogP-0.52
Rot. Bonds4

About (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol

(1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol (PubChem CID 135037817) has the molecular formula C10H20O6 and a molecular weight of 236.26 g/mol. Its IUPAC name is (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol.

Molecular Properties

Compound Name(1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol
PubChem CID135037817
Molecular FormulaC10H20O6
Molecular Weight236.26 g/mol
Exact Mass236.13
IUPAC Name(1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol
SMILESCOC1(C)OC[C@H]([C@H](O)CO)O[C@@]1(C)OC
InChIInChI=1S/C10H20O6/c1-9(13-3)10(2,14-4)16-8(6-15-9)7(12)5-11/h7-8,11-12H,5-6H2,1-4H3/t7-,8-,9?,10-/m1/s1
InChIKeyFSNHFIZWYUQRGJ-XKSJUCENSA-N
XLogP-0.52
TPSA77.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol?
The IUPAC name of (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol (CID 135037817) is (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol.
What is the SMILES notation for (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol?
The canonical SMILES for (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol is COC1(C)OC[C@H]([C@H](O)CO)O[C@@]1(C)OC.
What is the InChIKey of (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol?
The InChIKey is FSNHFIZWYUQRGJ-XKSJUCENSA-N. The full InChI is InChI=1S/C10H20O6/c1-9(13-3)10(2,14-4)16-8(6-15-9)7(12)5-11/h7-8,11-12H,5-6H2,1-4H3/t7-,8-,9?,10-/m1/s1.
What are the key properties of (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol?
(1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol has a molecular weight of 236.26 g/mol, XLogP of -0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[(2R,6R)-5,6-dimethoxy-5,6-dimethyl-1,4-dioxan-2-yl]ethane-1,2-diol is sourced from PubChem (CID 135037817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).