(2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane

C16H20O — CID 89174867

IUPAC(2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane
SMILESC=C/C=c1/o/c(=C\C(C)=C(C)C)c(=C)/c1=C/C
InChIInChI=1S/C16H20O/c1-7-9-15-14(8-2)13(6)16(17-15)10-12(5)11(3)4/h7-10H,1,6H2,2-5H3/b14-8-,15-9+,16-10+
InChIKeyCUBUASYLWQHBJC-IDZPMMSZSA-N
MW228.33 g/mol
LogP1.59
Rot. Bonds2

About (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane

(2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane (PubChem CID 89174867) has the molecular formula C16H20O and a molecular weight of 228.33 g/mol. Its IUPAC name is (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane.

Molecular Properties

Compound Name(2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane
PubChem CID89174867
Molecular FormulaC16H20O
Molecular Weight228.33 g/mol
Exact Mass228.15
IUPAC Name(2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane
SMILESC=C/C=c1/o/c(=C\C(C)=C(C)C)c(=C)/c1=C/C
InChIInChI=1S/C16H20O/c1-7-9-15-14(8-2)13(6)16(17-15)10-12(5)11(3)4/h7-10H,1,6H2,2-5H3/b14-8-,15-9+,16-10+
InChIKeyCUBUASYLWQHBJC-IDZPMMSZSA-N
XLogP1.59
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.33
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane?
The IUPAC name of (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane (CID 89174867) is (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane.
What is the SMILES notation for (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane?
The canonical SMILES for (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane is C=C/C=c1/o/c(=C\C(C)=C(C)C)c(=C)/c1=C/C.
What is the InChIKey of (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane?
The InChIKey is CUBUASYLWQHBJC-IDZPMMSZSA-N. The full InChI is InChI=1S/C16H20O/c1-7-9-15-14(8-2)13(6)16(17-15)10-12(5)11(3)4/h7-10H,1,6H2,2-5H3/b14-8-,15-9+,16-10+.
What are the key properties of (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane?
(2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane has a molecular weight of 228.33 g/mol, XLogP of 1.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z,5E)-2-(2,3-dimethylbut-2-enylidene)-4-ethylidene-3-methylidene-5-prop-2-enylideneoxolane is sourced from PubChem (CID 89174867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).