(4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane

C11H16O — CID 142171521

IUPAC(4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane
SMILESC=C1COCC/C1=C(C)/C=C\C
InChIInChI=1S/C11H16O/c1-4-5-9(2)11-6-7-12-8-10(11)3/h4-5H,3,6-8H2,1-2H3/b5-4-,11-9-
InChIKeyHMEJIYRRCCZBLT-JXWPTCDWSA-N
MW164.25 g/mol
LogP2.86
Rot. Bonds1

About (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane

(4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane (PubChem CID 142171521) has the molecular formula C11H16O and a molecular weight of 164.25 g/mol. Its IUPAC name is (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane.

Molecular Properties

Compound Name(4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane
PubChem CID142171521
Molecular FormulaC11H16O
Molecular Weight164.25 g/mol
Exact Mass164.12
IUPAC Name(4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane
SMILESC=C1COCC/C1=C(C)/C=C\C
InChIInChI=1S/C11H16O/c1-4-5-9(2)11-6-7-12-8-10(11)3/h4-5H,3,6-8H2,1-2H3/b5-4-,11-9-
InChIKeyHMEJIYRRCCZBLT-JXWPTCDWSA-N
XLogP2.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane?
The IUPAC name of (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane (CID 142171521) is (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane.
What is the SMILES notation for (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane?
The canonical SMILES for (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane is C=C1COCC/C1=C(C)/C=C\C.
What is the InChIKey of (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane?
The InChIKey is HMEJIYRRCCZBLT-JXWPTCDWSA-N. The full InChI is InChI=1S/C11H16O/c1-4-5-9(2)11-6-7-12-8-10(11)3/h4-5H,3,6-8H2,1-2H3/b5-4-,11-9-.
What are the key properties of (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane?
(4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane has a molecular weight of 164.25 g/mol, XLogP of 2.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-3-methylidene-4-[(Z)-pent-3-en-2-ylidene]oxane is sourced from PubChem (CID 142171521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).