(4R)-2-methylidene-4-propyloxolane

C8H14O — CID 134574950

IUPAC(4R)-2-methylidene-4-propyloxolane
SMILESC=C1C[C@@H](CCC)CO1
InChIInChI=1S/C8H14O/c1-3-4-8-5-7(2)9-6-8/h8H,2-6H2,1H3/t8-/m1/s1
InChIKeyROVDBWIWOSBJPL-MRVPVSSYSA-N
MW126.20 g/mol
LogP2.34
Rot. Bonds2

About (4R)-2-methylidene-4-propyloxolane

(4R)-2-methylidene-4-propyloxolane (PubChem CID 134574950) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is (4R)-2-methylidene-4-propyloxolane.

Molecular Properties

Compound Name(4R)-2-methylidene-4-propyloxolane
PubChem CID134574950
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name(4R)-2-methylidene-4-propyloxolane
SMILESC=C1C[C@@H](CCC)CO1
InChIInChI=1S/C8H14O/c1-3-4-8-5-7(2)9-6-8/h8H,2-6H2,1H3/t8-/m1/s1
InChIKeyROVDBWIWOSBJPL-MRVPVSSYSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4R)-2-methylidene-4-propyloxolane?
The IUPAC name of (4R)-2-methylidene-4-propyloxolane (CID 134574950) is (4R)-2-methylidene-4-propyloxolane.
What is the SMILES notation for (4R)-2-methylidene-4-propyloxolane?
The canonical SMILES for (4R)-2-methylidene-4-propyloxolane is C=C1C[C@@H](CCC)CO1.
What is the InChIKey of (4R)-2-methylidene-4-propyloxolane?
The InChIKey is ROVDBWIWOSBJPL-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H14O/c1-3-4-8-5-7(2)9-6-8/h8H,2-6H2,1H3/t8-/m1/s1.
What are the key properties of (4R)-2-methylidene-4-propyloxolane?
(4R)-2-methylidene-4-propyloxolane has a molecular weight of 126.20 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-methylidene-4-propyloxolane is sourced from PubChem (CID 134574950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).