(4R)-4-methoxy-2,4-dimethyloxan-3-ol

C8H16O3 — CID 89038479

IUPAC(4R)-4-methoxy-2,4-dimethyloxan-3-ol
SMILESCO[C@]1(C)CCOC(C)C1O
InChIInChI=1S/C8H16O3/c1-6-7(9)8(2,10-3)4-5-11-6/h6-7,9H,4-5H2,1-3H3/t6?,7?,8-/m1/s1
InChIKeyRMRBBZNNXRPEQH-KAVNDROISA-N
MW160.21 g/mol
LogP0.56
Rot. Bonds1

About (4R)-4-methoxy-2,4-dimethyloxan-3-ol

(4R)-4-methoxy-2,4-dimethyloxan-3-ol (PubChem CID 89038479) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is (4R)-4-methoxy-2,4-dimethyloxan-3-ol.

Molecular Properties

Compound Name(4R)-4-methoxy-2,4-dimethyloxan-3-ol
PubChem CID89038479
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name(4R)-4-methoxy-2,4-dimethyloxan-3-ol
SMILESCO[C@]1(C)CCOC(C)C1O
InChIInChI=1S/C8H16O3/c1-6-7(9)8(2,10-3)4-5-11-6/h6-7,9H,4-5H2,1-3H3/t6?,7?,8-/m1/s1
InChIKeyRMRBBZNNXRPEQH-KAVNDROISA-N
XLogP0.56
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-methoxy-2,4-dimethyloxan-3-ol?
The IUPAC name of (4R)-4-methoxy-2,4-dimethyloxan-3-ol (CID 89038479) is (4R)-4-methoxy-2,4-dimethyloxan-3-ol.
What is the SMILES notation for (4R)-4-methoxy-2,4-dimethyloxan-3-ol?
The canonical SMILES for (4R)-4-methoxy-2,4-dimethyloxan-3-ol is CO[C@]1(C)CCOC(C)C1O.
What is the InChIKey of (4R)-4-methoxy-2,4-dimethyloxan-3-ol?
The InChIKey is RMRBBZNNXRPEQH-KAVNDROISA-N. The full InChI is InChI=1S/C8H16O3/c1-6-7(9)8(2,10-3)4-5-11-6/h6-7,9H,4-5H2,1-3H3/t6?,7?,8-/m1/s1.
What are the key properties of (4R)-4-methoxy-2,4-dimethyloxan-3-ol?
(4R)-4-methoxy-2,4-dimethyloxan-3-ol has a molecular weight of 160.21 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methoxy-2,4-dimethyloxan-3-ol is sourced from PubChem (CID 89038479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).