(2R)-2-methyl-4-prop-1-en-2-yloxane

C9H16O — CID 90152455

IUPAC(2R)-2-methyl-4-prop-1-en-2-yloxane
SMILESC=C(C)C1CCO[C@H](C)C1
InChIInChI=1S/C9H16O/c1-7(2)9-4-5-10-8(3)6-9/h8-9H,1,4-6H2,2-3H3/t8-,9?/m1/s1
InChIKeyYYVNILDIRDDWIV-VEDVMXKPSA-N
MW140.23 g/mol
LogP2.38
Rot. Bonds1

About (2R)-2-methyl-4-prop-1-en-2-yloxane

(2R)-2-methyl-4-prop-1-en-2-yloxane (PubChem CID 90152455) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is (2R)-2-methyl-4-prop-1-en-2-yloxane.

Molecular Properties

Compound Name(2R)-2-methyl-4-prop-1-en-2-yloxane
PubChem CID90152455
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name(2R)-2-methyl-4-prop-1-en-2-yloxane
SMILESC=C(C)C1CCO[C@H](C)C1
InChIInChI=1S/C9H16O/c1-7(2)9-4-5-10-8(3)6-9/h8-9H,1,4-6H2,2-3H3/t8-,9?/m1/s1
InChIKeyYYVNILDIRDDWIV-VEDVMXKPSA-N
XLogP2.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-4-prop-1-en-2-yloxane?
The IUPAC name of (2R)-2-methyl-4-prop-1-en-2-yloxane (CID 90152455) is (2R)-2-methyl-4-prop-1-en-2-yloxane.
What is the SMILES notation for (2R)-2-methyl-4-prop-1-en-2-yloxane?
The canonical SMILES for (2R)-2-methyl-4-prop-1-en-2-yloxane is C=C(C)C1CCO[C@H](C)C1.
What is the InChIKey of (2R)-2-methyl-4-prop-1-en-2-yloxane?
The InChIKey is YYVNILDIRDDWIV-VEDVMXKPSA-N. The full InChI is InChI=1S/C9H16O/c1-7(2)9-4-5-10-8(3)6-9/h8-9H,1,4-6H2,2-3H3/t8-,9?/m1/s1.
What are the key properties of (2R)-2-methyl-4-prop-1-en-2-yloxane?
(2R)-2-methyl-4-prop-1-en-2-yloxane has a molecular weight of 140.23 g/mol, XLogP of 2.38, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-4-prop-1-en-2-yloxane is sourced from PubChem (CID 90152455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).