(6R)-2-methylidene-6-phenyloxane

C12H14O — CID 125486345

IUPAC(6R)-2-methylidene-6-phenyloxane
SMILESC=C1CCC[C@H](c2ccccc2)O1
InChIInChI=1S/C12H14O/c1-10-6-5-9-12(13-10)11-7-3-2-4-8-11/h2-4,7-8,12H,1,5-6,9H2/t12-/m1/s1
InChIKeySPABUHWGVDRXTK-GFCCVEGCSA-N
MW174.24 g/mol
LogP3.44
Rot. Bonds1

About (6R)-2-methylidene-6-phenyloxane

(6R)-2-methylidene-6-phenyloxane (PubChem CID 125486345) has the molecular formula C12H14O and a molecular weight of 174.24 g/mol. Its IUPAC name is (6R)-2-methylidene-6-phenyloxane.

Molecular Properties

Compound Name(6R)-2-methylidene-6-phenyloxane
PubChem CID125486345
Molecular FormulaC12H14O
Molecular Weight174.24 g/mol
Exact Mass174.10
IUPAC Name(6R)-2-methylidene-6-phenyloxane
SMILESC=C1CCC[C@H](c2ccccc2)O1
InChIInChI=1S/C12H14O/c1-10-6-5-9-12(13-10)11-7-3-2-4-8-11/h2-4,7-8,12H,1,5-6,9H2/t12-/m1/s1
InChIKeySPABUHWGVDRXTK-GFCCVEGCSA-N
XLogP3.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (6R)-2-methylidene-6-phenyloxane?
The IUPAC name of (6R)-2-methylidene-6-phenyloxane (CID 125486345) is (6R)-2-methylidene-6-phenyloxane.
What is the SMILES notation for (6R)-2-methylidene-6-phenyloxane?
The canonical SMILES for (6R)-2-methylidene-6-phenyloxane is C=C1CCC[C@H](c2ccccc2)O1.
What is the InChIKey of (6R)-2-methylidene-6-phenyloxane?
The InChIKey is SPABUHWGVDRXTK-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H14O/c1-10-6-5-9-12(13-10)11-7-3-2-4-8-11/h2-4,7-8,12H,1,5-6,9H2/t12-/m1/s1.
What are the key properties of (6R)-2-methylidene-6-phenyloxane?
(6R)-2-methylidene-6-phenyloxane has a molecular weight of 174.24 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-2-methylidene-6-phenyloxane is sourced from PubChem (CID 125486345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).