(3R)-3-methoxy-4-methyloxolane

C6H12O2 — CID 147902074

IUPAC(3R)-3-methoxy-4-methyloxolane
SMILESCO[C@H]1COCC1C
InChIInChI=1S/C6H12O2/c1-5-3-8-4-6(5)7-2/h5-6H,3-4H2,1-2H3/t5?,6-/m0/s1
InChIKeyIELRVSHSMOMLQC-GDVGLLTNSA-N
MW116.16 g/mol
LogP0.67
Rot. Bonds1

About (3R)-3-methoxy-4-methyloxolane

(3R)-3-methoxy-4-methyloxolane (PubChem CID 147902074) has the molecular formula C6H12O2 and a molecular weight of 116.16 g/mol. Its IUPAC name is (3R)-3-methoxy-4-methyloxolane.

Molecular Properties

Compound Name(3R)-3-methoxy-4-methyloxolane
PubChem CID147902074
Molecular FormulaC6H12O2
Molecular Weight116.16 g/mol
Exact Mass116.08
IUPAC Name(3R)-3-methoxy-4-methyloxolane
SMILESCO[C@H]1COCC1C
InChIInChI=1S/C6H12O2/c1-5-3-8-4-6(5)7-2/h5-6H,3-4H2,1-2H3/t5?,6-/m0/s1
InChIKeyIELRVSHSMOMLQC-GDVGLLTNSA-N
XLogP0.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-methoxy-4-methyloxolane?
The IUPAC name of (3R)-3-methoxy-4-methyloxolane (CID 147902074) is (3R)-3-methoxy-4-methyloxolane.
What is the SMILES notation for (3R)-3-methoxy-4-methyloxolane?
The canonical SMILES for (3R)-3-methoxy-4-methyloxolane is CO[C@H]1COCC1C.
What is the InChIKey of (3R)-3-methoxy-4-methyloxolane?
The InChIKey is IELRVSHSMOMLQC-GDVGLLTNSA-N. The full InChI is InChI=1S/C6H12O2/c1-5-3-8-4-6(5)7-2/h5-6H,3-4H2,1-2H3/t5?,6-/m0/s1.
What are the key properties of (3R)-3-methoxy-4-methyloxolane?
(3R)-3-methoxy-4-methyloxolane has a molecular weight of 116.16 g/mol, XLogP of 0.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methoxy-4-methyloxolane is sourced from PubChem (CID 147902074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).